2,2-difluoro-N-[(1-methylcyclopentyl)methyl]acetamide

C9H15F2NO — CID 103515473

IUPAC2,2-difluoro-N-[(1-methylcyclopentyl)methyl]acetamide
SMILESCC1(CNC(=O)C(F)F)CCCC1
InChIInChI=1S/C9H15F2NO/c1-9(4-2-3-5-9)6-12-8(13)7(10)11/h7H,2-6H2,1H3,(H,12,13)
InChIKeyURNGDVBVVUTGJD-UHFFFAOYSA-N
MW191.22 g/mol
LogP1.95
Rot. Bonds3

About 2,2-difluoro-N-[(1-methylcyclopentyl)methyl]acetamide

2,2-difluoro-N-[(1-methylcyclopentyl)methyl]acetamide (PubChem CID 103515473) has the molecular formula C9H15F2NO and a molecular weight of 191.22 g/mol. Its IUPAC name is 2,2-difluoro-N-[(1-methylcyclopentyl)methyl]acetamide.

Molecular Properties

Compound Name2,2-difluoro-N-[(1-methylcyclopentyl)methyl]acetamide
PubChem CID103515473
Molecular FormulaC9H15F2NO
Molecular Weight191.22 g/mol
Exact Mass191.11
IUPAC Name2,2-difluoro-N-[(1-methylcyclopentyl)methyl]acetamide
SMILESCC1(CNC(=O)C(F)F)CCCC1
InChIInChI=1S/C9H15F2NO/c1-9(4-2-3-5-9)6-12-8(13)7(10)11/h7H,2-6H2,1H3,(H,12,13)
InChIKeyURNGDVBVVUTGJD-UHFFFAOYSA-N
XLogP1.95
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.22
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-methyl-N-[(1-methylcyclobutyl)methyl]propanamide
CID 103737357
(2R)-2-amino-N-[(1-methylcyclohexyl)methyl]propanamide
CID 103798136
2-amino-N-[(1-methylcyclohexyl)methyl]propanamide
CID 103798125
N-[(1-aminocyclopentyl)methyl]-2,2-difluoroacetamide
CID 164661336
N-[(1-methylcycloheptyl)methyl]acetamide
CID 127751208
2-cyano-N-[(1-methylcyclopentyl)methyl]propanamide
CID 63829788
3-amino-2-methyl-N-[(1-methylcyclohexyl)methyl]butanamide
CID 103581061
2,2-difluoro-N-[(1-fluorocyclobutyl)methyl]acetamide
CID 130666100
2,2-difluoro-N-[[1-(hydroxymethyl)cyclopropyl]methyl]acetamide
CID 103513976
N-[[1-(dimethylamino)cyclobutyl]methyl]-2,2-difluoroacetamide
CID 103516127
(2S)-2-amino-4-methyl-N-[(1-methylcyclopentyl)methyl]pentanamide;hydrochloride
CID 119780580
2-amino-N-[(1-methylcyclohexyl)methyl]hexanamide
CID 103832772

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-N-[(1-methylcyclopentyl)methyl]acetamide?
The IUPAC name of 2,2-difluoro-N-[(1-methylcyclopentyl)methyl]acetamide (CID 103515473) is 2,2-difluoro-N-[(1-methylcyclopentyl)methyl]acetamide.
What is the SMILES notation for 2,2-difluoro-N-[(1-methylcyclopentyl)methyl]acetamide?
The canonical SMILES for 2,2-difluoro-N-[(1-methylcyclopentyl)methyl]acetamide is CC1(CNC(=O)C(F)F)CCCC1.
What is the InChIKey of 2,2-difluoro-N-[(1-methylcyclopentyl)methyl]acetamide?
The InChIKey is URNGDVBVVUTGJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F2NO/c1-9(4-2-3-5-9)6-12-8(13)7(10)11/h7H,2-6H2,1H3,(H,12,13).
What are the key properties of 2,2-difluoro-N-[(1-methylcyclopentyl)methyl]acetamide?
2,2-difluoro-N-[(1-methylcyclopentyl)methyl]acetamide has a molecular weight of 191.22 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-N-[(1-methylcyclopentyl)methyl]acetamide is sourced from PubChem (CID 103515473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).