3,3-difluoro-N,N-dimethylbutanamide

C6H11F2NO — CID 130667654

IUPAC3,3-difluoro-N,N-dimethylbutanamide
SMILESCN(C)C(=O)CC(C)(F)F
InChIInChI=1S/C6H11F2NO/c1-6(7,8)4-5(10)9(2)3/h4H2,1-3H3
InChIKeyZNQYQKFSCGAZPE-UHFFFAOYSA-N
MW151.16 g/mol
LogP1.12
Rot. Bonds2

About 3,3-difluoro-N,N-dimethylbutanamide

3,3-difluoro-N,N-dimethylbutanamide (PubChem CID 130667654) has the molecular formula C6H11F2NO and a molecular weight of 151.16 g/mol. Its IUPAC name is 3,3-difluoro-N,N-dimethylbutanamide.

Molecular Properties

Compound Name3,3-difluoro-N,N-dimethylbutanamide
PubChem CID130667654
Molecular FormulaC6H11F2NO
Molecular Weight151.16 g/mol
Exact Mass151.08
IUPAC Name3,3-difluoro-N,N-dimethylbutanamide
SMILESCN(C)C(=O)CC(C)(F)F
InChIInChI=1S/C6H11F2NO/c1-6(7,8)4-5(10)9(2)3/h4H2,1-3H3
InChIKeyZNQYQKFSCGAZPE-UHFFFAOYSA-N
XLogP1.12
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.16
LogP ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N,N,3-trimethyl-3-sulfanylbutanamide
CID 90216913
N,N,3,3-tetramethylpentanamide
CID 23394541
N,N,3,3-tetramethylpent-4-enamide
CID 13020109
(3R)-3,5-dihydroxy-N,N,3-trimethylpentanamide
CID 87266925
ethyl 4-(dimethylamino)-2-hydroxy-2-methyl-4-oxobutanoate
CID 87491131
4,5-dichloro-N,N,3,3-tetramethylpentanamide
CID 170564857
5,5-difluoro-2-methylhexan-3-one
CID 88577617
tert-butyl 2-amino-4-(dimethylamino)-2-methyl-4-oxobutanoate
CID 175133888
[2-(dimethylamino)-2-oxoethyl] 2,2,2-trifluoroacetate
CID 174583979
3-amino-4,4,4-trifluoro-N,N-dimethylbutanamide
CID 58772889
N,N-dimethyl-3-(trifluoromethylsulfanyl)propanamide
CID 130427166
N,N-dimethyl-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 12636379

Frequently Asked Questions

What is the IUPAC name of 3,3-difluoro-N,N-dimethylbutanamide?
The IUPAC name of 3,3-difluoro-N,N-dimethylbutanamide (CID 130667654) is 3,3-difluoro-N,N-dimethylbutanamide.
What is the SMILES notation for 3,3-difluoro-N,N-dimethylbutanamide?
The canonical SMILES for 3,3-difluoro-N,N-dimethylbutanamide is CN(C)C(=O)CC(C)(F)F.
What is the InChIKey of 3,3-difluoro-N,N-dimethylbutanamide?
The InChIKey is ZNQYQKFSCGAZPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F2NO/c1-6(7,8)4-5(10)9(2)3/h4H2,1-3H3.
What are the key properties of 3,3-difluoro-N,N-dimethylbutanamide?
3,3-difluoro-N,N-dimethylbutanamide has a molecular weight of 151.16 g/mol, XLogP of 1.12, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-difluoro-N,N-dimethylbutanamide is sourced from PubChem (CID 130667654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).