4-hydroxy-3-methyl-N-[(4-methylcyclohexyl)methyl]benzamide

C16H23NO2 — CID 103956686

IUPAC4-hydroxy-3-methyl-N-[(4-methylcyclohexyl)methyl]benzamide
SMILESCc1cc(C(=O)NCC2CCC(C)CC2)ccc1O
InChIInChI=1S/C16H23NO2/c1-11-3-5-13(6-4-11)10-17-16(19)14-7-8-15(18)12(2)9-14/h7-9,11,13,18H,3-6,10H2,1-2H3,(H,17,19)
InChIKeyPNALMDQUFKTHTP-UHFFFAOYSA-N
MW261.37 g/mol
LogP3.26
Rot. Bonds3

About 4-hydroxy-3-methyl-N-[(4-methylcyclohexyl)methyl]benzamide

4-hydroxy-3-methyl-N-[(4-methylcyclohexyl)methyl]benzamide (PubChem CID 103956686) has the molecular formula C16H23NO2 and a molecular weight of 261.37 g/mol. Its IUPAC name is 4-hydroxy-3-methyl-N-[(4-methylcyclohexyl)methyl]benzamide.

Molecular Properties

Compound Name4-hydroxy-3-methyl-N-[(4-methylcyclohexyl)methyl]benzamide
PubChem CID103956686
Molecular FormulaC16H23NO2
Molecular Weight261.37 g/mol
Exact Mass261.17
IUPAC Name4-hydroxy-3-methyl-N-[(4-methylcyclohexyl)methyl]benzamide
SMILESCc1cc(C(=O)NCC2CCC(C)CC2)ccc1O
InChIInChI=1S/C16H23NO2/c1-11-3-5-13(6-4-11)10-17-16(19)14-7-8-15(18)12(2)9-14/h7-9,11,13,18H,3-6,10H2,1-2H3,(H,17,19)
InChIKeyPNALMDQUFKTHTP-UHFFFAOYSA-N
XLogP3.26
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-hydroxy-3-methyl-N-(piperidin-4-ylmethyl)benzamide
CID 107671970
N-[(1-ethylpiperidin-4-yl)methyl]-4-hydroxy-3-methylbenzamide
CID 103956695
4-(ethylamino)-3-methyl-N-[(4-methylcyclohexyl)methyl]benzamide
CID 63247733
4-hydroxy-3-methyl-N-[(2-methylcyclopentyl)methyl]benzamide
CID 107676879
N-(3-cyclopropylpropyl)-4-hydroxy-3-methylbenzamide
CID 103957172
N-[(4-methylcyclohexyl)methyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
CID 104614995
N-(cyclohexylmethyl)-3,4-dimethylbenzamide
CID 55349047
4-fluoro-N-[(4-hydroxycyclohexyl)methyl]-3-methylbenzamide
CID 114146256
3-chloro-N-[(4-ethylcyclohexyl)methyl]-4-hydroxybenzamide
CID 47441341
N-[(1,4-dimethylpiperazin-2-yl)methyl]-4-hydroxy-3-methylbenzamide
CID 103957035
N-(2-bicyclo[2.2.1]heptanylmethyl)-4-hydroxy-3-methylbenzamide
CID 103956855
N-(cyclopentylmethyl)-4-fluoro-3-methylbenzamide
CID 55163457

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-3-methyl-N-[(4-methylcyclohexyl)methyl]benzamide?
The IUPAC name of 4-hydroxy-3-methyl-N-[(4-methylcyclohexyl)methyl]benzamide (CID 103956686) is 4-hydroxy-3-methyl-N-[(4-methylcyclohexyl)methyl]benzamide.
What is the SMILES notation for 4-hydroxy-3-methyl-N-[(4-methylcyclohexyl)methyl]benzamide?
The canonical SMILES for 4-hydroxy-3-methyl-N-[(4-methylcyclohexyl)methyl]benzamide is Cc1cc(C(=O)NCC2CCC(C)CC2)ccc1O.
What is the InChIKey of 4-hydroxy-3-methyl-N-[(4-methylcyclohexyl)methyl]benzamide?
The InChIKey is PNALMDQUFKTHTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO2/c1-11-3-5-13(6-4-11)10-17-16(19)14-7-8-15(18)12(2)9-14/h7-9,11,13,18H,3-6,10H2,1-2H3,(H,17,19).
What are the key properties of 4-hydroxy-3-methyl-N-[(4-methylcyclohexyl)methyl]benzamide?
4-hydroxy-3-methyl-N-[(4-methylcyclohexyl)methyl]benzamide has a molecular weight of 261.37 g/mol, XLogP of 3.26, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-3-methyl-N-[(4-methylcyclohexyl)methyl]benzamide is sourced from PubChem (CID 103956686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).