N-cyclopentyl-3-hydroxy-2-methylbenzamide

C13H17NO2 — CID 82786265

IUPACN-cyclopentyl-3-hydroxy-2-methylbenzamide
SMILESCc1c(O)cccc1C(=O)NC1CCCC1
InChIInChI=1S/C13H17NO2/c1-9-11(7-4-8-12(9)15)13(16)14-10-5-2-3-6-10/h4,7-8,10,15H,2-3,5-6H2,1H3,(H,14,16)
InChIKeyCISMCXYLMSXKDS-UHFFFAOYSA-N
MW219.28 g/mol
LogP2.37
Rot. Bonds2

About N-cyclopentyl-3-hydroxy-2-methylbenzamide

N-cyclopentyl-3-hydroxy-2-methylbenzamide (PubChem CID 82786265) has the molecular formula C13H17NO2 and a molecular weight of 219.28 g/mol. Its IUPAC name is N-cyclopentyl-3-hydroxy-2-methylbenzamide.

Molecular Properties

Compound NameN-cyclopentyl-3-hydroxy-2-methylbenzamide
PubChem CID82786265
Molecular FormulaC13H17NO2
Molecular Weight219.28 g/mol
Exact Mass219.13
IUPAC NameN-cyclopentyl-3-hydroxy-2-methylbenzamide
SMILESCc1c(O)cccc1C(=O)NC1CCCC1
InChIInChI=1S/C13H17NO2/c1-9-11(7-4-8-12(9)15)13(16)14-10-5-2-3-6-10/h4,7-8,10,15H,2-3,5-6H2,1H3,(H,14,16)
InChIKeyCISMCXYLMSXKDS-UHFFFAOYSA-N
XLogP2.37
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-hydroxy-2-methyl-N-(oxan-3-yl)benzamide
CID 82829580
3-amino-N-cyclobutyl-2-methylbenzamide
CID 62416681
2-[3-(cyclohexylcarbamoyl)-2-methylphenyl]acetic acid
CID 121005204
3-hydroxy-2-methyl-N-(2-methylcycloheptyl)benzamide
CID 82829354
2-[(3-hydroxy-2-methylbenzoyl)amino]cycloheptane-1-carboxylic acid
CID 82809247
N-cyclobutyl-2-hydroxy-3-methylbenzamide
CID 62416564
N-(1-cyclopentylethyl)-3-hydroxy-2-methylbenzamide
CID 82828967
N-cyclohexyl-2-methylpyridine-3-carboxamide
CID 78951017
N-cycloheptyl-2-fluoro-3-methylbenzamide
CID 80719060
3-chloro-N-cyclohexyl-2-methylbenzamide;pyrrolidine
CID 143582754
N-cyclobutyl-2-fluoro-3-methylbenzamide
CID 80712137
N-(cyclohexylmethyl)-3-hydroxy-2-methylbenzamide
CID 82826551

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-hydroxy-2-methylbenzamide?
The IUPAC name of N-cyclopentyl-3-hydroxy-2-methylbenzamide (CID 82786265) is N-cyclopentyl-3-hydroxy-2-methylbenzamide.
What is the SMILES notation for N-cyclopentyl-3-hydroxy-2-methylbenzamide?
The canonical SMILES for N-cyclopentyl-3-hydroxy-2-methylbenzamide is Cc1c(O)cccc1C(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-3-hydroxy-2-methylbenzamide?
The InChIKey is CISMCXYLMSXKDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO2/c1-9-11(7-4-8-12(9)15)13(16)14-10-5-2-3-6-10/h4,7-8,10,15H,2-3,5-6H2,1H3,(H,14,16).
What are the key properties of N-cyclopentyl-3-hydroxy-2-methylbenzamide?
N-cyclopentyl-3-hydroxy-2-methylbenzamide has a molecular weight of 219.28 g/mol, XLogP of 2.37, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-hydroxy-2-methylbenzamide is sourced from PubChem (CID 82786265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).