2,4-dihydroxy-N-(3-methylcyclohexyl)benzamide

C14H19NO3 — CID 103612467

IUPAC2,4-dihydroxy-N-(3-methylcyclohexyl)benzamide
SMILESCC1CCCC(NC(=O)c2ccc(O)cc2O)C1
InChIInChI=1S/C14H19NO3/c1-9-3-2-4-10(7-9)15-14(18)12-6-5-11(16)8-13(12)17/h5-6,8-10,16-17H,2-4,7H2,1H3,(H,15,18)
InChIKeyRORSZMPNNXVPKM-UHFFFAOYSA-N
MW249.31 g/mol
LogP2.41
Rot. Bonds2

About 2,4-dihydroxy-N-(3-methylcyclohexyl)benzamide

2,4-dihydroxy-N-(3-methylcyclohexyl)benzamide (PubChem CID 103612467) has the molecular formula C14H19NO3 and a molecular weight of 249.31 g/mol. Its IUPAC name is 2,4-dihydroxy-N-(3-methylcyclohexyl)benzamide.

Molecular Properties

Compound Name2,4-dihydroxy-N-(3-methylcyclohexyl)benzamide
PubChem CID103612467
Molecular FormulaC14H19NO3
Molecular Weight249.31 g/mol
Exact Mass249.14
IUPAC Name2,4-dihydroxy-N-(3-methylcyclohexyl)benzamide
SMILESCC1CCCC(NC(=O)c2ccc(O)cc2O)C1
InChIInChI=1S/C14H19NO3/c1-9-3-2-4-10(7-9)15-14(18)12-6-5-11(16)8-13(12)17/h5-6,8-10,16-17H,2-4,7H2,1H3,(H,15,18)
InChIKeyRORSZMPNNXVPKM-UHFFFAOYSA-N
XLogP2.41
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 52.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-dihydroxy-N-(3-methylcyclopentyl)benzamide
CID 107723891
1-N,2-N,3-N-tris(3-methylcyclohexyl)benzene-1,2,3-tricarboxamide
CID 141437065
3-[(2-hydroxy-4-methoxybenzoyl)amino]cyclohexane-1-carboxylic acid
CID 63043634
2,4-dihydroxy-N-(oxan-3-yl)benzamide
CID 113232786
N-cyclobutyl-2-hydroxy-4-methylbenzamide
CID 62416758
N-cyclobutyl-4-hydroxy-2-methylbenzamide
CID 103865467
N-(4-chlorocyclohexyl)-2,4-dihydroxybenzamide
CID 107725924
2-amino-4-chloro-N-[(1S,3S)-3-methylcyclohexyl]benzamide
CID 28690168
N-(3,5-dimethylcyclohexyl)-2,5-dihydroxybenzamide
CID 107723193
2,4-dihydroxy-N-(4-oxocyclohexyl)benzamide
CID 107722193
2,4-dihydroxy-N-(2-methylcycloheptyl)benzamide
CID 103714355
2-fluoro-N-[(1R,3R)-3-methylcyclohexyl]benzamide
CID 41097250

Frequently Asked Questions

What is the IUPAC name of 2,4-dihydroxy-N-(3-methylcyclohexyl)benzamide?
The IUPAC name of 2,4-dihydroxy-N-(3-methylcyclohexyl)benzamide (CID 103612467) is 2,4-dihydroxy-N-(3-methylcyclohexyl)benzamide.
What is the SMILES notation for 2,4-dihydroxy-N-(3-methylcyclohexyl)benzamide?
The canonical SMILES for 2,4-dihydroxy-N-(3-methylcyclohexyl)benzamide is CC1CCCC(NC(=O)c2ccc(O)cc2O)C1.
What is the InChIKey of 2,4-dihydroxy-N-(3-methylcyclohexyl)benzamide?
The InChIKey is RORSZMPNNXVPKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO3/c1-9-3-2-4-10(7-9)15-14(18)12-6-5-11(16)8-13(12)17/h5-6,8-10,16-17H,2-4,7H2,1H3,(H,15,18).
What are the key properties of 2,4-dihydroxy-N-(3-methylcyclohexyl)benzamide?
2,4-dihydroxy-N-(3-methylcyclohexyl)benzamide has a molecular weight of 249.31 g/mol, XLogP of 2.41, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dihydroxy-N-(3-methylcyclohexyl)benzamide is sourced from PubChem (CID 103612467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).