N-(3,3-dimethylcyclopentyl)-2-hydroxy-4-methoxybenzamide

C15H21NO3 — CID 115881718

IUPACN-(3,3-dimethylcyclopentyl)-2-hydroxy-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC2CCC(C)(C)C2)c(O)c1
InChIInChI=1S/C15H21NO3/c1-15(2)7-6-10(9-15)16-14(18)12-5-4-11(19-3)8-13(12)17/h4-5,8,10,17H,6-7,9H2,1-3H3,(H,16,18)
InChIKeyJWHFSYRHWSLCST-UHFFFAOYSA-N
MW263.34 g/mol
LogP2.71
Rot. Bonds3

About N-(3,3-dimethylcyclopentyl)-2-hydroxy-4-methoxybenzamide

N-(3,3-dimethylcyclopentyl)-2-hydroxy-4-methoxybenzamide (PubChem CID 115881718) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-(3,3-dimethylcyclopentyl)-2-hydroxy-4-methoxybenzamide.

Molecular Properties

Compound NameN-(3,3-dimethylcyclopentyl)-2-hydroxy-4-methoxybenzamide
PubChem CID115881718
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC NameN-(3,3-dimethylcyclopentyl)-2-hydroxy-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC2CCC(C)(C)C2)c(O)c1
InChIInChI=1S/C15H21NO3/c1-15(2)7-6-10(9-15)16-14(18)12-5-4-11(19-3)8-13(12)17/h4-5,8,10,17H,6-7,9H2,1-3H3,(H,16,18)
InChIKeyJWHFSYRHWSLCST-UHFFFAOYSA-N
XLogP2.71
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-hydroxy-4-methoxy-N-(oxan-4-yl)benzamide
CID 43610298
2-hydroxy-4-methoxy-N-(3-methylcyclobutyl)benzamide
CID 115671067
2-hydroxy-4-methoxy-N-(2,2,3,3-tetramethylcyclopropyl)benzamide
CID 79351166
4-[(2-hydroxy-4-methoxybenzoyl)amino]cyclohexane-1-carboxylic acid
CID 60810345
3-bromo-N-(3,3-dimethylcyclopentyl)-2,5-dimethoxybenzamide
CID 115880854
N-(2,2-dimethylcyclohexyl)-2-hydroxy-4-methoxybenzamide
CID 79877931
2-hydroxy-4-methoxy-N-(1-methylpyrrolidin-3-yl)benzamide
CID 47375174
2-[(2-hydroxy-4-methoxybenzoyl)amino]-1-methylcyclopentane-1-carboxylic acid
CID 82765367
3-[(2-hydroxy-4-methoxybenzoyl)amino]cyclohexane-1-carboxylic acid
CID 63043634
2-hydroxy-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methoxybenzamide
CID 104956910
N-(3-amino-2,2-dimethylcyclobutyl)-2-hydroxy-4-methoxybenzamide
CID 114632319
2-hydroxy-4-methoxy-N-(1-methylcyclobutyl)benzamide
CID 113346628

Frequently Asked Questions

What is the IUPAC name of N-(3,3-dimethylcyclopentyl)-2-hydroxy-4-methoxybenzamide?
The IUPAC name of N-(3,3-dimethylcyclopentyl)-2-hydroxy-4-methoxybenzamide (CID 115881718) is N-(3,3-dimethylcyclopentyl)-2-hydroxy-4-methoxybenzamide.
What is the SMILES notation for N-(3,3-dimethylcyclopentyl)-2-hydroxy-4-methoxybenzamide?
The canonical SMILES for N-(3,3-dimethylcyclopentyl)-2-hydroxy-4-methoxybenzamide is COc1ccc(C(=O)NC2CCC(C)(C)C2)c(O)c1.
What is the InChIKey of N-(3,3-dimethylcyclopentyl)-2-hydroxy-4-methoxybenzamide?
The InChIKey is JWHFSYRHWSLCST-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-15(2)7-6-10(9-15)16-14(18)12-5-4-11(19-3)8-13(12)17/h4-5,8,10,17H,6-7,9H2,1-3H3,(H,16,18).
What are the key properties of N-(3,3-dimethylcyclopentyl)-2-hydroxy-4-methoxybenzamide?
N-(3,3-dimethylcyclopentyl)-2-hydroxy-4-methoxybenzamide has a molecular weight of 263.34 g/mol, XLogP of 2.71, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-dimethylcyclopentyl)-2-hydroxy-4-methoxybenzamide is sourced from PubChem (CID 115881718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).