3-cyclopentyl-N-(2-hydroxy-4-methylphenyl)propanamide

C15H21NO2 — CID 7979725

IUPAC3-cyclopentyl-N-(2-hydroxy-4-methylphenyl)propanamide
SMILESCc1ccc(NC(=O)CCC2CCCC2)c(O)c1
InChIInChI=1S/C15H21NO2/c1-11-6-8-13(14(17)10-11)16-15(18)9-7-12-4-2-3-5-12/h6,8,10,12,17H,2-5,7,9H2,1H3,(H,16,18)
InChIKeyPYBPOXZBFSDCRK-UHFFFAOYSA-N
MW247.34 g/mol
LogP3.61
Rot. Bonds4

About 3-cyclopentyl-N-(2-hydroxy-4-methylphenyl)propanamide

3-cyclopentyl-N-(2-hydroxy-4-methylphenyl)propanamide (PubChem CID 7979725) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is 3-cyclopentyl-N-(2-hydroxy-4-methylphenyl)propanamide.

Molecular Properties

Compound Name3-cyclopentyl-N-(2-hydroxy-4-methylphenyl)propanamide
PubChem CID7979725
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC Name3-cyclopentyl-N-(2-hydroxy-4-methylphenyl)propanamide
SMILESCc1ccc(NC(=O)CCC2CCCC2)c(O)c1
InChIInChI=1S/C15H21NO2/c1-11-6-8-13(14(17)10-11)16-15(18)9-7-12-4-2-3-5-12/h6,8,10,12,17H,2-5,7,9H2,1H3,(H,16,18)
InChIKeyPYBPOXZBFSDCRK-UHFFFAOYSA-N
XLogP3.61
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

N-(2-acetamido-5-methylphenyl)-3-cyclohexylpropanamide
CID 131913766
N-(2-bromo-5-methylphenyl)-3-cyclopentylpropanamide
CID 82757064
3-cyclopentyl-N-[2-(3-hydroxyprop-1-ynyl)-4-methylphenyl]propanamide
CID 60803312
3-cyclopentyl-N-[2-(3-hydroxyprop-1-ynyl)-5-methylphenyl]propanamide
CID 82746748
N-[2-(2-hydroxy-4-methylanilino)-2-oxoethyl]cyclopentanecarboxamide
CID 46450422
N-[2-(3-aminoprop-1-ynyl)-4-methylphenyl]-3-cyclopentylpropanamide
CID 60813037
N-(2-acetamidophenyl)-3-cyclopentylpropanamide
CID 976246
2-(1-hydroxycyclopentyl)-N-(2-hydroxy-4-methylphenyl)acetamide
CID 111430326
N-(2-hydroxy-4-methylphenyl)hept-6-ynamide
CID 103907404
N-(2,4-dimethylphenyl)-3-(1-methylpiperidin-4-yl)propanamide
CID 110857210
N-(2-hydroxy-4-methylphenyl)pent-4-enamide
CID 62677203
9-(2-hydroxy-4-methylanilino)-9-oxononanoic acid
CID 22468230

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-(2-hydroxy-4-methylphenyl)propanamide?
The IUPAC name of 3-cyclopentyl-N-(2-hydroxy-4-methylphenyl)propanamide (CID 7979725) is 3-cyclopentyl-N-(2-hydroxy-4-methylphenyl)propanamide.
What is the SMILES notation for 3-cyclopentyl-N-(2-hydroxy-4-methylphenyl)propanamide?
The canonical SMILES for 3-cyclopentyl-N-(2-hydroxy-4-methylphenyl)propanamide is Cc1ccc(NC(=O)CCC2CCCC2)c(O)c1.
What is the InChIKey of 3-cyclopentyl-N-(2-hydroxy-4-methylphenyl)propanamide?
The InChIKey is PYBPOXZBFSDCRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-11-6-8-13(14(17)10-11)16-15(18)9-7-12-4-2-3-5-12/h6,8,10,12,17H,2-5,7,9H2,1H3,(H,16,18).
What are the key properties of 3-cyclopentyl-N-(2-hydroxy-4-methylphenyl)propanamide?
3-cyclopentyl-N-(2-hydroxy-4-methylphenyl)propanamide has a molecular weight of 247.34 g/mol, XLogP of 3.61, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-(2-hydroxy-4-methylphenyl)propanamide is sourced from PubChem (CID 7979725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).