N-(3-hydroxyphenyl)-4-methylcyclohexane-1-carboxamide

C14H19NO2 — CID 113287962

IUPACN-(3-hydroxyphenyl)-4-methylcyclohexane-1-carboxamide
SMILESCC1CCC(C(=O)Nc2cccc(O)c2)CC1
InChIInChI=1S/C14H19NO2/c1-10-5-7-11(8-6-10)14(17)15-12-3-2-4-13(16)9-12/h2-4,9-11,16H,5-8H2,1H3,(H,15,17)
InChIKeyBZRGARGFUCRYHC-UHFFFAOYSA-N
MW233.31 g/mol
LogP3.16
Rot. Bonds2

About N-(3-hydroxyphenyl)-4-methylcyclohexane-1-carboxamide

N-(3-hydroxyphenyl)-4-methylcyclohexane-1-carboxamide (PubChem CID 113287962) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is N-(3-hydroxyphenyl)-4-methylcyclohexane-1-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxyphenyl)-4-methylcyclohexane-1-carboxamide
PubChem CID113287962
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC NameN-(3-hydroxyphenyl)-4-methylcyclohexane-1-carboxamide
SMILESCC1CCC(C(=O)Nc2cccc(O)c2)CC1
InChIInChI=1S/C14H19NO2/c1-10-5-7-11(8-6-10)14(17)15-12-3-2-4-13(16)9-12/h2-4,9-11,16H,5-8H2,1H3,(H,15,17)
InChIKeyBZRGARGFUCRYHC-UHFFFAOYSA-N
XLogP3.16
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-hydroxyphenyl)pyrrolidine-3-carboxamide
CID 63006855
(3R)-N-(3-hydroxyphenyl)pyrrolidine-3-carboxamide
CID 94916708
4-methyl-N-naphthalen-2-ylcyclohexane-1-carboxamide
CID 775974
(2S,4R)-2-methyl-N-[3-[(4-methylcyclohexanecarbonyl)amino]phenyl]-6-oxopiperidine-4-carboxamide
CID 166375292
N-(4-anilinophenyl)-4-methylcyclohexane-1-carboxamide
CID 110178754
N-(3-hydroxyphenyl)-5-methyloxolane-2-carboxamide
CID 81330062
N-[3-[(2,5-dimethylcyclohexyl)amino]phenyl]cyclopropanecarboxamide
CID 64773730
N-[3-(butanoylamino)phenyl]cyclopropanecarboxamide
CID 17187554
4-fluoro-N-[3-[(4-fluorocyclohexanecarbonyl)amino]phenyl]cyclohexane-1-carboxamide
CID 171577056
4-N-(3,5-dimethylphenyl)-1-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide
CID 109150418
N-[3-(2,2-dimethylpropanoylamino)phenyl]cyclopropanecarboxamide
CID 17204538
cis-(1S,2R)-2-[(3-hydroxyphenyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 11877929

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxyphenyl)-4-methylcyclohexane-1-carboxamide?
The IUPAC name of N-(3-hydroxyphenyl)-4-methylcyclohexane-1-carboxamide (CID 113287962) is N-(3-hydroxyphenyl)-4-methylcyclohexane-1-carboxamide.
What is the SMILES notation for N-(3-hydroxyphenyl)-4-methylcyclohexane-1-carboxamide?
The canonical SMILES for N-(3-hydroxyphenyl)-4-methylcyclohexane-1-carboxamide is CC1CCC(C(=O)Nc2cccc(O)c2)CC1.
What is the InChIKey of N-(3-hydroxyphenyl)-4-methylcyclohexane-1-carboxamide?
The InChIKey is BZRGARGFUCRYHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-10-5-7-11(8-6-10)14(17)15-12-3-2-4-13(16)9-12/h2-4,9-11,16H,5-8H2,1H3,(H,15,17).
What are the key properties of N-(3-hydroxyphenyl)-4-methylcyclohexane-1-carboxamide?
N-(3-hydroxyphenyl)-4-methylcyclohexane-1-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 3.16, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxyphenyl)-4-methylcyclohexane-1-carboxamide is sourced from PubChem (CID 113287962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).