N-cyclopent-3-en-1-yl-4-hydroxy-3-methylbenzamide

C13H15NO2 — CID 103957515

IUPACN-cyclopent-3-en-1-yl-4-hydroxy-3-methylbenzamide
SMILESCc1cc(C(=O)NC2CC=CC2)ccc1O
InChIInChI=1S/C13H15NO2/c1-9-8-10(6-7-12(9)15)13(16)14-11-4-2-3-5-11/h2-3,6-8,11,15H,4-5H2,1H3,(H,14,16)
InChIKeyRMKPRPCGUJNTIR-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.15
Rot. Bonds2

About N-cyclopent-3-en-1-yl-4-hydroxy-3-methylbenzamide

N-cyclopent-3-en-1-yl-4-hydroxy-3-methylbenzamide (PubChem CID 103957515) has the molecular formula C13H15NO2 and a molecular weight of 217.27 g/mol. Its IUPAC name is N-cyclopent-3-en-1-yl-4-hydroxy-3-methylbenzamide.

Molecular Properties

Compound NameN-cyclopent-3-en-1-yl-4-hydroxy-3-methylbenzamide
PubChem CID103957515
Molecular FormulaC13H15NO2
Molecular Weight217.27 g/mol
Exact Mass217.11
IUPAC NameN-cyclopent-3-en-1-yl-4-hydroxy-3-methylbenzamide
SMILESCc1cc(C(=O)NC2CC=CC2)ccc1O
InChIInChI=1S/C13H15NO2/c1-9-8-10(6-7-12(9)15)13(16)14-11-4-2-3-5-11/h2-3,6-8,11,15H,4-5H2,1H3,(H,14,16)
InChIKeyRMKPRPCGUJNTIR-UHFFFAOYSA-N
XLogP2.15
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-cyclohexyl-4-hydroxy-3-methylbenzamide
CID 113355938
4-hydroxy-3-methyl-N-(3,3,5,5-tetramethylcyclohexyl)benzamide
CID 107676803
4-hydroxy-3-methyl-N-(4-propylcyclohexyl)benzamide
CID 107676630
N-[(3aS,7aR)-2,3,3a,4,5,6,7,7a-octahydro-1H-isoindol-5-yl]-4-hydroxy-3-methylbenzamide
CID 107675666
4-hydroxy-3-methyl-N-(1-propylpiperidin-4-yl)benzamide
CID 103951674
4-hydroxy-3-methyl-N-(2-methylcyclopentyl)benzamide
CID 113358322
N-(2-aminocycloheptyl)-4-hydroxy-3-methylbenzamide
CID 107672030
N-cyclobutyl-3,4-dimethylbenzamide;ethane
CID 142916267
3-[(4-hydroxy-3-methylbenzoyl)amino]-4-methylbenzoic acid
CID 107674655
4-bromo-3-chloro-N-cyclopent-3-en-1-ylbenzamide
CID 115703314
N-(2-cyanocyclopentyl)-4-hydroxy-3-methylbenzamide
CID 113358590
N-(3-ethyl-2-methylcyclopentyl)-4-hydroxy-3-methylbenzamide
CID 107676725

Frequently Asked Questions

What is the IUPAC name of N-cyclopent-3-en-1-yl-4-hydroxy-3-methylbenzamide?
The IUPAC name of N-cyclopent-3-en-1-yl-4-hydroxy-3-methylbenzamide (CID 103957515) is N-cyclopent-3-en-1-yl-4-hydroxy-3-methylbenzamide.
What is the SMILES notation for N-cyclopent-3-en-1-yl-4-hydroxy-3-methylbenzamide?
The canonical SMILES for N-cyclopent-3-en-1-yl-4-hydroxy-3-methylbenzamide is Cc1cc(C(=O)NC2CC=CC2)ccc1O.
What is the InChIKey of N-cyclopent-3-en-1-yl-4-hydroxy-3-methylbenzamide?
The InChIKey is RMKPRPCGUJNTIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO2/c1-9-8-10(6-7-12(9)15)13(16)14-11-4-2-3-5-11/h2-3,6-8,11,15H,4-5H2,1H3,(H,14,16).
What are the key properties of N-cyclopent-3-en-1-yl-4-hydroxy-3-methylbenzamide?
N-cyclopent-3-en-1-yl-4-hydroxy-3-methylbenzamide has a molecular weight of 217.27 g/mol, XLogP of 2.15, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopent-3-en-1-yl-4-hydroxy-3-methylbenzamide is sourced from PubChem (CID 103957515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).