2-hydroxy-4-methoxy-N-(3-methylcyclobutyl)benzamide

C13H17NO3 — CID 115671067

IUPAC2-hydroxy-4-methoxy-N-(3-methylcyclobutyl)benzamide
SMILESCOc1ccc(C(=O)NC2CC(C)C2)c(O)c1
InChIInChI=1S/C13H17NO3/c1-8-5-9(6-8)14-13(16)11-4-3-10(17-2)7-12(11)15/h3-4,7-9,15H,5-6H2,1-2H3,(H,14,16)
InChIKeyQKPRDMMPBSPGGA-UHFFFAOYSA-N
MW235.28 g/mol
LogP1.93
Rot. Bonds3

About 2-hydroxy-4-methoxy-N-(3-methylcyclobutyl)benzamide

2-hydroxy-4-methoxy-N-(3-methylcyclobutyl)benzamide (PubChem CID 115671067) has the molecular formula C13H17NO3 and a molecular weight of 235.28 g/mol. Its IUPAC name is 2-hydroxy-4-methoxy-N-(3-methylcyclobutyl)benzamide.

Molecular Properties

Compound Name2-hydroxy-4-methoxy-N-(3-methylcyclobutyl)benzamide
PubChem CID115671067
Molecular FormulaC13H17NO3
Molecular Weight235.28 g/mol
Exact Mass235.12
IUPAC Name2-hydroxy-4-methoxy-N-(3-methylcyclobutyl)benzamide
SMILESCOc1ccc(C(=O)NC2CC(C)C2)c(O)c1
InChIInChI=1S/C13H17NO3/c1-8-5-9(6-8)14-13(16)11-4-3-10(17-2)7-12(11)15/h3-4,7-9,15H,5-6H2,1-2H3,(H,14,16)
InChIKeyQKPRDMMPBSPGGA-UHFFFAOYSA-N
XLogP1.93
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.28
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(3,5-dimethylcyclohexyl)-4-methoxybenzamide
CID 115413365
3-[(2-hydroxy-4-methoxybenzoyl)amino]cyclohexane-1-carboxylic acid
CID 63043634
2-hydroxy-4-methoxy-N-(oxan-4-yl)benzamide
CID 43610298
N-(2-aminocyclopropyl)-2-hydroxy-4-methoxybenzamide
CID 43593875
4-[(2-hydroxy-4-methoxybenzoyl)amino]cyclohexane-1-carboxylic acid
CID 60810345
N-(3,5-dimethylcyclohexyl)-2,5-dihydroxybenzamide
CID 107723193
2-hydroxy-4-methoxy-N-(1-methylpyrrolidin-3-yl)benzamide
CID 47375174
N-(3,3-dimethylcyclopentyl)-2-hydroxy-4-methoxybenzamide
CID 115881718
2-hydroxy-4-methoxy-N-(2,2,3,3-tetramethylcyclopropyl)benzamide
CID 79351166
2-hydroxy-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methoxybenzamide
CID 104956910
N-(3-amino-2,2-dimethylcyclobutyl)-2-hydroxy-4-methoxybenzamide
CID 114632319
2-amino-5-hydroxy-N-(3-methylcyclobutyl)benzamide
CID 107076024

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-4-methoxy-N-(3-methylcyclobutyl)benzamide?
The IUPAC name of 2-hydroxy-4-methoxy-N-(3-methylcyclobutyl)benzamide (CID 115671067) is 2-hydroxy-4-methoxy-N-(3-methylcyclobutyl)benzamide.
What is the SMILES notation for 2-hydroxy-4-methoxy-N-(3-methylcyclobutyl)benzamide?
The canonical SMILES for 2-hydroxy-4-methoxy-N-(3-methylcyclobutyl)benzamide is COc1ccc(C(=O)NC2CC(C)C2)c(O)c1.
What is the InChIKey of 2-hydroxy-4-methoxy-N-(3-methylcyclobutyl)benzamide?
The InChIKey is QKPRDMMPBSPGGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO3/c1-8-5-9(6-8)14-13(16)11-4-3-10(17-2)7-12(11)15/h3-4,7-9,15H,5-6H2,1-2H3,(H,14,16).
What are the key properties of 2-hydroxy-4-methoxy-N-(3-methylcyclobutyl)benzamide?
2-hydroxy-4-methoxy-N-(3-methylcyclobutyl)benzamide has a molecular weight of 235.28 g/mol, XLogP of 1.93, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-4-methoxy-N-(3-methylcyclobutyl)benzamide is sourced from PubChem (CID 115671067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).