N-[3-(1-aminoethyl)phenyl]cyclopentanecarboxamide

C14H20N2O — CID 16787772

IUPACN-[3-(1-aminoethyl)phenyl]cyclopentanecarboxamide
SMILESCC(N)c1cccc(NC(=O)C2CCCC2)c1
InChIInChI=1S/C14H20N2O/c1-10(15)12-7-4-8-13(9-12)16-14(17)11-5-2-3-6-11/h4,7-11H,2-3,5-6,15H2,1H3,(H,16,17)
InChIKeyOXQVHUJBECRABI-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.84
Rot. Bonds3

About N-[3-(1-aminoethyl)phenyl]cyclopentanecarboxamide

N-[3-(1-aminoethyl)phenyl]cyclopentanecarboxamide (PubChem CID 16787772) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is N-[3-(1-aminoethyl)phenyl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[3-(1-aminoethyl)phenyl]cyclopentanecarboxamide
PubChem CID16787772
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC NameN-[3-(1-aminoethyl)phenyl]cyclopentanecarboxamide
SMILESCC(N)c1cccc(NC(=O)C2CCCC2)c1
InChIInChI=1S/C14H20N2O/c1-10(15)12-7-4-8-13(9-12)16-14(17)11-5-2-3-6-11/h4,7-11H,2-3,5-6,15H2,1H3,(H,16,17)
InChIKeyOXQVHUJBECRABI-UHFFFAOYSA-N
XLogP2.84
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-(1-aminoethyl)phenyl]cyclohexanecarboxamide
CID 16796065
N-[3-[1-(methylamino)ethyl]phenyl]cyclobutanecarboxamide
CID 43507810
1-[3-(1-aminoethyl)phenyl]-3-cyclopentylurea
CID 61339811
N-[1-(3-acetamidophenyl)ethyl]cyclohexanecarboxamide
CID 46580283
4-amino-N-(3-propan-2-ylphenyl)cyclohexane-1-carboxamide
CID 60848284
N-[3-[1-hydroxy-2-(methylamino)ethyl]phenyl]cyclopentanecarboxamide
CID 68644459
N-[3-[[(2S)-2-amino-4-methylpentanoyl]amino]phenyl]cyclohexanecarboxamide;hydrochloride
CID 119814666
N-[3-(3,3-dideuterio-1-hydroxybutyl)phenyl]cyclohexanecarboxamide
CID 90337055
N-[3-[[(2S)-2-aminopropanoyl]amino]phenyl]cyclopropanecarboxamide
CID 78968942
methyl 2-[[3-(cyclohexanecarbonylamino)benzoyl]amino]-2-phenylacetate
CID 60609882
N-[3-(propan-2-ylamino)phenyl]cyclopropanecarboxamide
CID 28620650
3-(cyclohexanecarbonylamino)-N-(1-hydroxypropan-2-yl)benzamide
CID 78866259

Frequently Asked Questions

What is the IUPAC name of N-[3-(1-aminoethyl)phenyl]cyclopentanecarboxamide?
The IUPAC name of N-[3-(1-aminoethyl)phenyl]cyclopentanecarboxamide (CID 16787772) is N-[3-(1-aminoethyl)phenyl]cyclopentanecarboxamide.
What is the SMILES notation for N-[3-(1-aminoethyl)phenyl]cyclopentanecarboxamide?
The canonical SMILES for N-[3-(1-aminoethyl)phenyl]cyclopentanecarboxamide is CC(N)c1cccc(NC(=O)C2CCCC2)c1.
What is the InChIKey of N-[3-(1-aminoethyl)phenyl]cyclopentanecarboxamide?
The InChIKey is OXQVHUJBECRABI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-10(15)12-7-4-8-13(9-12)16-14(17)11-5-2-3-6-11/h4,7-11H,2-3,5-6,15H2,1H3,(H,16,17).
What are the key properties of N-[3-(1-aminoethyl)phenyl]cyclopentanecarboxamide?
N-[3-(1-aminoethyl)phenyl]cyclopentanecarboxamide has a molecular weight of 232.33 g/mol, XLogP of 2.84, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(1-aminoethyl)phenyl]cyclopentanecarboxamide is sourced from PubChem (CID 16787772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).