N-[3-[1-hydroxy-2-(methylamino)ethyl]phenyl]cyclopentanecarboxamide

C15H22N2O2 — CID 68644459

IUPACN-[3-[1-hydroxy-2-(methylamino)ethyl]phenyl]cyclopentanecarboxamide
SMILESCNCC(O)c1cccc(NC(=O)C2CCCC2)c1
InChIInChI=1S/C15H22N2O2/c1-16-10-14(18)12-7-4-8-13(9-12)17-15(19)11-5-2-3-6-11/h4,7-9,11,14,16,18H,2-3,5-6,10H2,1H3,(H,17,19)
InChIKeyHVKIMZFBQICLFB-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.07
Rot. Bonds5

About N-[3-[1-hydroxy-2-(methylamino)ethyl]phenyl]cyclopentanecarboxamide

N-[3-[1-hydroxy-2-(methylamino)ethyl]phenyl]cyclopentanecarboxamide (PubChem CID 68644459) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-[3-[1-hydroxy-2-(methylamino)ethyl]phenyl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[3-[1-hydroxy-2-(methylamino)ethyl]phenyl]cyclopentanecarboxamide
PubChem CID68644459
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-[3-[1-hydroxy-2-(methylamino)ethyl]phenyl]cyclopentanecarboxamide
SMILESCNCC(O)c1cccc(NC(=O)C2CCCC2)c1
InChIInChI=1S/C15H22N2O2/c1-16-10-14(18)12-7-4-8-13(9-12)17-15(19)11-5-2-3-6-11/h4,7-9,11,14,16,18H,2-3,5-6,10H2,1H3,(H,17,19)
InChIKeyHVKIMZFBQICLFB-UHFFFAOYSA-N
XLogP2.07
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-[3-[1-hydroxy-2-(methylamino)ethyl]phenyl]cyclopentanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[3-(3,3-dideuterio-1-hydroxybutyl)phenyl]cyclohexanecarboxamide
CID 90337055
N-[3-(1-aminoethyl)phenyl]cyclohexanecarboxamide
CID 16796065
N-[3-(1-aminoethyl)phenyl]cyclopentanecarboxamide
CID 16787772
N-[3-[1-(methylamino)ethyl]phenyl]cyclobutanecarboxamide
CID 43507810
N-[3-[[2-methyl-3-(methylamino)propanoyl]amino]phenyl]cyclopropanecarboxamide
CID 79201789
N-[(2S)-2-hydroxy-2-phenylethyl]cyclopentanecarboxamide
CID 93032915
3-(cyclohexanecarbonylamino)-N-(2-hydroxypropyl)benzamide
CID 78866245
N-(3-acetamidophenyl)cyclobutanecarboxamide
CID 2666370
N-[3-(butanoylamino)phenyl]cyclopentanecarboxamide
CID 47309445
N-[(2S)-2-(3-chlorophenyl)-2-hydroxyethyl]cyclohexanecarboxamide
CID 51941928
N-[1-(3-acetamidophenyl)ethyl]cyclohexanecarboxamide
CID 46580283
4-amino-N-(3-propan-2-ylphenyl)cyclohexane-1-carboxamide
CID 60848284

Frequently Asked Questions

What is the IUPAC name of N-[3-[1-hydroxy-2-(methylamino)ethyl]phenyl]cyclopentanecarboxamide?
The IUPAC name of N-[3-[1-hydroxy-2-(methylamino)ethyl]phenyl]cyclopentanecarboxamide (CID 68644459) is N-[3-[1-hydroxy-2-(methylamino)ethyl]phenyl]cyclopentanecarboxamide.
What is the SMILES notation for N-[3-[1-hydroxy-2-(methylamino)ethyl]phenyl]cyclopentanecarboxamide?
The canonical SMILES for N-[3-[1-hydroxy-2-(methylamino)ethyl]phenyl]cyclopentanecarboxamide is CNCC(O)c1cccc(NC(=O)C2CCCC2)c1.
What is the InChIKey of N-[3-[1-hydroxy-2-(methylamino)ethyl]phenyl]cyclopentanecarboxamide?
The InChIKey is HVKIMZFBQICLFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-16-10-14(18)12-7-4-8-13(9-12)17-15(19)11-5-2-3-6-11/h4,7-9,11,14,16,18H,2-3,5-6,10H2,1H3,(H,17,19).
What are the key properties of N-[3-[1-hydroxy-2-(methylamino)ethyl]phenyl]cyclopentanecarboxamide?
N-[3-[1-hydroxy-2-(methylamino)ethyl]phenyl]cyclopentanecarboxamide has a molecular weight of 262.35 g/mol, XLogP of 2.07, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[1-hydroxy-2-(methylamino)ethyl]phenyl]cyclopentanecarboxamide is sourced from PubChem (CID 68644459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).