N-(3,3-difluoroprop-2-enyl)-N-methylpropanamide

C7H11F2NO — CID 20644848

IUPACN-(3,3-difluoroprop-2-enyl)-N-methylpropanamide
SMILESCCC(=O)N(C)CC=C(F)F
InChIInChI=1S/C7H11F2NO/c1-3-7(11)10(2)5-4-6(8)9/h4H,3,5H2,1-2H3
InChIKeyPPZVFACREPAHEU-UHFFFAOYSA-N
MW163.17 g/mol
LogP1.64
Rot. Bonds3

About N-(3,3-difluoroprop-2-enyl)-N-methylpropanamide

N-(3,3-difluoroprop-2-enyl)-N-methylpropanamide (PubChem CID 20644848) has the molecular formula C7H11F2NO and a molecular weight of 163.17 g/mol. Its IUPAC name is N-(3,3-difluoroprop-2-enyl)-N-methylpropanamide.

Molecular Properties

Compound NameN-(3,3-difluoroprop-2-enyl)-N-methylpropanamide
PubChem CID20644848
Molecular FormulaC7H11F2NO
Molecular Weight163.17 g/mol
Exact Mass163.08
IUPAC NameN-(3,3-difluoroprop-2-enyl)-N-methylpropanamide
SMILESCCC(=O)N(C)CC=C(F)F
InChIInChI=1S/C7H11F2NO/c1-3-7(11)10(2)5-4-6(8)9/h4H,3,5H2,1-2H3
InChIKeyPPZVFACREPAHEU-UHFFFAOYSA-N
XLogP1.64
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.17
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N-(3,3-difluoroprop-2-enyl)-N-methylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,N-Diallyl-2,2,2-trifluoroacetamide
CID 246339
N,N-Diethyl-3,3,3-trifluoropropanamide
CID 14383591
N,N-diethyl-2-(trifluoromethyl)prop-2-enamide
CID 134988475
N,N-Diethyl-2,2-difluoropropanamide
CID 10909906
2,2,2-Trifluoro-N-methyl-N-(prop-2-en-1-yl)acetamide
CID 19426657
N,N-diethyl-3,4,4-trifluorobut-3-enamide
CID 20093640
N-(3,3-difluoroprop-2-enyl)-N-methylbutanamide
CID 20644845
N-(3,3-difluoroprop-2-enyl)-N-methylpentanamide
CID 20644847
3,3,3-trifluoro-N-methyl-N-prop-2-enylpropanamide
CID 22975872
2,2,2-Trifluoro-1-(3-methyl-2,5-dihydropyrrol-1-yl)ethanone
CID 58450998
2,2,2-trifluoro-N-(2-methylprop-2-enyl)-N-prop-2-enylacetamide
CID 58683581
N-methyl-N-(2,2,2-trifluoroethyl)propanamide
CID 60758458

Frequently Asked Questions

What is the IUPAC name of N-(3,3-difluoroprop-2-enyl)-N-methylpropanamide?
The IUPAC name of N-(3,3-difluoroprop-2-enyl)-N-methylpropanamide (CID 20644848) is N-(3,3-difluoroprop-2-enyl)-N-methylpropanamide.
What is the SMILES notation for N-(3,3-difluoroprop-2-enyl)-N-methylpropanamide?
The canonical SMILES for N-(3,3-difluoroprop-2-enyl)-N-methylpropanamide is CCC(=O)N(C)CC=C(F)F.
What is the InChIKey of N-(3,3-difluoroprop-2-enyl)-N-methylpropanamide?
The InChIKey is PPZVFACREPAHEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F2NO/c1-3-7(11)10(2)5-4-6(8)9/h4H,3,5H2,1-2H3.
What are the key properties of N-(3,3-difluoroprop-2-enyl)-N-methylpropanamide?
N-(3,3-difluoroprop-2-enyl)-N-methylpropanamide has a molecular weight of 163.17 g/mol, XLogP of 1.64, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-difluoroprop-2-enyl)-N-methylpropanamide is sourced from PubChem (CID 20644848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).