3,3-Dimethylbutanamide

Product Information

Molecular Formula:
C6H13NO
Molecular Weight:
115.17
Description
Applications: 3,3-Dimethylbutanamide is a useful research chemical.
Synonyms
NSC 1145||||NSC 165573||||NSC 400229||||t-Butylacetamide||||tert-Butylacetamide
IUPAC Name
3,3-dimethylbutanamide
Canonical SMILES
CC(C)(C)CC(=O)N
InChI
InChI=1S/C6H13NO/c1-6(2,3)4-5(7)8/h4H2,1-3H3,(H2,7,8)
InChI Key
LINZZISWCNKFEM-UHFFFAOYSA-N

Computed Properties

XLogP3
0.8
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
1
Rotatable Bond Count
2
Exact Mass
115.099714038 g/mol
Monoisotopic Mass
115.099714038 g/mol
Topological Polar Surface Area
43.1Ų
Heavy Atom Count
8
Formal Charge
0
Complexity
91.2
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
WO-2021055538-A1 Methods of use for kv7 channel activators 2019-09-17
US-2020109141-A1 Amino acid compounds and methods of use 2018-10-08
WO-2020071550-A1 Cdk8 inhibitor and use of same 2018-10-04
WO-2020067144-A1 Nucleating agnet, synthetic-resin composition containing same, and molded object thereof 2018-09-26
WO-2019174279-A1 1,2-benzisoselenazol-3(2h)-one and 1,2-benzisothiazol-3(2h)-one derivatives as beta-lactam antibiotic adjuvants 2018-03-13
US-2020399243-A1 Novel compounds 2018-03-02
US-2019298857-A1 Polymer-based nanoparticles, related formulations methods, and apparatus 2018-01-09
US-2019185449-A1 Oxopiperazine derivatives 2017-12-15
US-10710975-B2 Oxopiperazine derivatives 2017-12-15
US-2021177917-A1 Molecular bacteriotherapy to control skin enzymatic activity 2017-08-31

Literatures

PMID Publication Date Title Journal
19877649 2009-11-26 Synthesis and evaluation of antiallodynic and anticonvulsant activity of novel amide and urea derivatives of valproic acid analogues Journal of medicinal chemistry
12175338 2002-12-15 Interaction of the verotoxin 1B subunit with soluble aminodeoxy analogues of globotriaosyl ceramides The Biochemical journal
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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