3,3-difluoro-N-methylcyclopentane-1-carboxamide

C7H11F2NO — CID 118333876

IUPAC3,3-difluoro-N-methylcyclopentane-1-carboxamide
SMILESCNC(=O)C1CCC(F)(F)C1
InChIInChI=1S/C7H11F2NO/c1-10-6(11)5-2-3-7(8,9)4-5/h5H,2-4H2,1H3,(H,10,11)
InChIKeyFTDCAIVQSGOLOX-UHFFFAOYSA-N
MW163.17 g/mol
LogP1.17
Rot. Bonds1

About 3,3-difluoro-N-methylcyclopentane-1-carboxamide

3,3-difluoro-N-methylcyclopentane-1-carboxamide (PubChem CID 118333876) has the molecular formula C7H11F2NO and a molecular weight of 163.17 g/mol. Its IUPAC name is 3,3-difluoro-N-methylcyclopentane-1-carboxamide.

Molecular Properties

Compound Name3,3-difluoro-N-methylcyclopentane-1-carboxamide
PubChem CID118333876
Molecular FormulaC7H11F2NO
Molecular Weight163.17 g/mol
Exact Mass163.08
IUPAC Name3,3-difluoro-N-methylcyclopentane-1-carboxamide
SMILESCNC(=O)C1CCC(F)(F)C1
InChIInChI=1S/C7H11F2NO/c1-10-6(11)5-2-3-7(8,9)4-5/h5H,2-4H2,1H3,(H,10,11)
InChIKeyFTDCAIVQSGOLOX-UHFFFAOYSA-N
XLogP1.17
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.17
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-methylspiro[2.5]octane-6-carboxamide
CID 59578553
1-amino-3-(methylcarbamoyl)cyclopentan-1-olate
CID 59468682
(1S)-3,3-difluoro-N-[[(2R)-spiro[2.2]pentan-2-yl]methyl]cyclopentane-1-carboxamide
CID 129348874
(3,3-difluorocyclopentyl) N-methylcarbamate
CID 118332585
(2S,3S)-2-[(3,3-difluorocyclopentanecarbonyl)amino]-3-methylpentanoic acid
CID 114226158
3,3-difluoro-N-prop-2-ynoxycyclopentane-1-carboxamide
CID 130611796
N,3,3,4-tetramethylcyclohexane-1-carboxamide
CID 166762823
3,3-difluoro-N-[2-(2-methoxyethylamino)ethyl]cyclopentane-1-carboxamide
CID 114226519
N-(2-bromo-3-ethylpentyl)-3,3-difluorocyclopentane-1-carboxamide
CID 114226698
N-ethoxy-3,3-difluorocyclohexane-1-carboxamide
CID 130487784
1-(4,4-difluorocyclohexanecarbonyl)-N,4-dimethyl-1,4-diazepane-6-carboxamide
CID 110098458
(6R)-1-(4,4-difluorocyclohexanecarbonyl)-N,4-dimethyl-1,4-diazepane-6-carboxamide
CID 124973963

Frequently Asked Questions

What is the IUPAC name of 3,3-difluoro-N-methylcyclopentane-1-carboxamide?
The IUPAC name of 3,3-difluoro-N-methylcyclopentane-1-carboxamide (CID 118333876) is 3,3-difluoro-N-methylcyclopentane-1-carboxamide.
What is the SMILES notation for 3,3-difluoro-N-methylcyclopentane-1-carboxamide?
The canonical SMILES for 3,3-difluoro-N-methylcyclopentane-1-carboxamide is CNC(=O)C1CCC(F)(F)C1.
What is the InChIKey of 3,3-difluoro-N-methylcyclopentane-1-carboxamide?
The InChIKey is FTDCAIVQSGOLOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F2NO/c1-10-6(11)5-2-3-7(8,9)4-5/h5H,2-4H2,1H3,(H,10,11).
What are the key properties of 3,3-difluoro-N-methylcyclopentane-1-carboxamide?
3,3-difluoro-N-methylcyclopentane-1-carboxamide has a molecular weight of 163.17 g/mol, XLogP of 1.17, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-difluoro-N-methylcyclopentane-1-carboxamide is sourced from PubChem (CID 118333876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).