N-(2-cyano-4-fluorophenyl)-2-(cyclopentylamino)acetamide

C14H16FN3O — CID 82015810

IUPACN-(2-cyano-4-fluorophenyl)-2-(cyclopentylamino)acetamide
SMILESN#Cc1cc(F)ccc1NC(=O)CNC1CCCC1
InChIInChI=1S/C14H16FN3O/c15-11-5-6-13(10(7-11)8-16)18-14(19)9-17-12-3-1-2-4-12/h5-7,12,17H,1-4,9H2,(H,18,19)
InChIKeyMIPDYUMTUONZNS-UHFFFAOYSA-N
MW261.30 g/mol
LogP2.17
Rot. Bonds4

About N-(2-cyano-4-fluorophenyl)-2-(cyclopentylamino)acetamide

N-(2-cyano-4-fluorophenyl)-2-(cyclopentylamino)acetamide (PubChem CID 82015810) has the molecular formula C14H16FN3O and a molecular weight of 261.30 g/mol. Its IUPAC name is N-(2-cyano-4-fluorophenyl)-2-(cyclopentylamino)acetamide.

Molecular Properties

Compound NameN-(2-cyano-4-fluorophenyl)-2-(cyclopentylamino)acetamide
PubChem CID82015810
Molecular FormulaC14H16FN3O
Molecular Weight261.30 g/mol
Exact Mass261.13
IUPAC NameN-(2-cyano-4-fluorophenyl)-2-(cyclopentylamino)acetamide
SMILESN#Cc1cc(F)ccc1NC(=O)CNC1CCCC1
InChIInChI=1S/C14H16FN3O/c15-11-5-6-13(10(7-11)8-16)18-14(19)9-17-12-3-1-2-4-12/h5-7,12,17H,1-4,9H2,(H,18,19)
InChIKeyMIPDYUMTUONZNS-UHFFFAOYSA-N
XLogP2.17
TPSA64.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.30
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclooctylamino)-N-(2,4-difluorophenyl)acetamide
CID 9265336
methyl 2-[[2-(cyclopentylamino)acetyl]amino]-5-fluorobenzoate
CID 60850707
N-(2-cyano-4-fluorophenyl)propanamide
CID 79952819
4-[[2-(cyclopentylamino)acetyl]amino]-3-fluorobenzoic acid
CID 63187706
N-(2-cyano-4-fluorophenyl)-2-(thian-4-yl)acetamide
CID 80709860
2-(cyclopentylamino)-N-(2-fluoro-4-methylphenyl)acetamide
CID 60648408
2-(azetidin-3-yl)-N-(2-cyano-4-fluorophenyl)acetamide
CID 82015908
N-(2-cyano-4-fluorophenyl)-3-sulfanylpropanamide
CID 107033592
N-(2-cyano-4-fluorophenyl)-3-piperidin-4-ylpropanamide
CID 82016419
1-(2-cyano-4-fluorophenyl)-3-[2-(hydroxymethyl)cyclohexyl]urea
CID 111926835
N-(2-cyano-4-fluorophenyl)-3,3-dimethylbutanamide
CID 79953681
N-(2-chloro-5-fluorophenyl)-2-(cyclopropylamino)acetamide
CID 103843641

Frequently Asked Questions

What is the IUPAC name of N-(2-cyano-4-fluorophenyl)-2-(cyclopentylamino)acetamide?
The IUPAC name of N-(2-cyano-4-fluorophenyl)-2-(cyclopentylamino)acetamide (CID 82015810) is N-(2-cyano-4-fluorophenyl)-2-(cyclopentylamino)acetamide.
What is the SMILES notation for N-(2-cyano-4-fluorophenyl)-2-(cyclopentylamino)acetamide?
The canonical SMILES for N-(2-cyano-4-fluorophenyl)-2-(cyclopentylamino)acetamide is N#Cc1cc(F)ccc1NC(=O)CNC1CCCC1.
What is the InChIKey of N-(2-cyano-4-fluorophenyl)-2-(cyclopentylamino)acetamide?
The InChIKey is MIPDYUMTUONZNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3O/c15-11-5-6-13(10(7-11)8-16)18-14(19)9-17-12-3-1-2-4-12/h5-7,12,17H,1-4,9H2,(H,18,19).
What are the key properties of N-(2-cyano-4-fluorophenyl)-2-(cyclopentylamino)acetamide?
N-(2-cyano-4-fluorophenyl)-2-(cyclopentylamino)acetamide has a molecular weight of 261.30 g/mol, XLogP of 2.17, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyano-4-fluorophenyl)-2-(cyclopentylamino)acetamide is sourced from PubChem (CID 82015810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).