N-(3-cyano-4-fluorophenyl)-2-cyclopentylacetamide

C14H15FN2O — CID 62315620

IUPACN-(3-cyano-4-fluorophenyl)-2-cyclopentylacetamide
SMILESN#Cc1cc(NC(=O)CC2CCCC2)ccc1F
InChIInChI=1S/C14H15FN2O/c15-13-6-5-12(8-11(13)9-16)17-14(18)7-10-3-1-2-4-10/h5-6,8,10H,1-4,7H2,(H,17,18)
InChIKeySOIVWJRQSMIUSZ-UHFFFAOYSA-N
MW246.28 g/mol
LogP3.22
Rot. Bonds3

About N-(3-cyano-4-fluorophenyl)-2-cyclopentylacetamide

N-(3-cyano-4-fluorophenyl)-2-cyclopentylacetamide (PubChem CID 62315620) has the molecular formula C14H15FN2O and a molecular weight of 246.28 g/mol. Its IUPAC name is N-(3-cyano-4-fluorophenyl)-2-cyclopentylacetamide.

Molecular Properties

Compound NameN-(3-cyano-4-fluorophenyl)-2-cyclopentylacetamide
PubChem CID62315620
Molecular FormulaC14H15FN2O
Molecular Weight246.28 g/mol
Exact Mass246.12
IUPAC NameN-(3-cyano-4-fluorophenyl)-2-cyclopentylacetamide
SMILESN#Cc1cc(NC(=O)CC2CCCC2)ccc1F
InChIInChI=1S/C14H15FN2O/c15-13-6-5-12(8-11(13)9-16)17-14(18)7-10-3-1-2-4-10/h5-6,8,10H,1-4,7H2,(H,17,18)
InChIKeySOIVWJRQSMIUSZ-UHFFFAOYSA-N
XLogP3.22
TPSA52.89 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.28
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-cyano-4-fluorophenyl)-2-(3-ethoxycyclobutyl)acetamide
CID 103163570
N-(3-cyano-4-fluorophenyl)bicyclo[4.1.0]heptane-7-carboxamide
CID 79208842
2-cyclohexyl-N-(4-fluoro-3-nitrophenyl)acetamide
CID 4784963
N-(3-amino-4-fluorophenyl)-2-cyclobutylacetamide
CID 103805248
N-(3-cyano-4-fluorophenyl)-2-(2,3-dihydro-1H-inden-1-yl)acetamide
CID 86955794
N-(4-cyanophenyl)-2-cycloheptylacetamide
CID 115679897
2-cyclopentyl-N-[3-fluoro-4-(3-hydroxyprop-1-ynyl)phenyl]acetamide
CID 65434302
5-(cyclohexylmethylamino)-2-fluorobenzonitrile
CID 62317493
2-(4-cyclohexylcyclohexyl)-N-(3,4-difluorophenyl)acetamide
CID 121325202
2-cyclopentyl-N-[3-fluoro-4-(methylamino)phenyl]acetamide
CID 167956029
N-(3-cyanophenyl)-2-cycloheptylacetamide
CID 115679873
N-(3-cyano-4-fluorophenyl)-2-morpholin-2-ylacetamide
CID 66427683

Frequently Asked Questions

What is the IUPAC name of N-(3-cyano-4-fluorophenyl)-2-cyclopentylacetamide?
The IUPAC name of N-(3-cyano-4-fluorophenyl)-2-cyclopentylacetamide (CID 62315620) is N-(3-cyano-4-fluorophenyl)-2-cyclopentylacetamide.
What is the SMILES notation for N-(3-cyano-4-fluorophenyl)-2-cyclopentylacetamide?
The canonical SMILES for N-(3-cyano-4-fluorophenyl)-2-cyclopentylacetamide is N#Cc1cc(NC(=O)CC2CCCC2)ccc1F.
What is the InChIKey of N-(3-cyano-4-fluorophenyl)-2-cyclopentylacetamide?
The InChIKey is SOIVWJRQSMIUSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O/c15-13-6-5-12(8-11(13)9-16)17-14(18)7-10-3-1-2-4-10/h5-6,8,10H,1-4,7H2,(H,17,18).
What are the key properties of N-(3-cyano-4-fluorophenyl)-2-cyclopentylacetamide?
N-(3-cyano-4-fluorophenyl)-2-cyclopentylacetamide has a molecular weight of 246.28 g/mol, XLogP of 3.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyano-4-fluorophenyl)-2-cyclopentylacetamide is sourced from PubChem (CID 62315620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).