4-hydroxy-N-[(1-hydroxy-4-methylcyclohexyl)methyl]benzamide

C15H21NO3 — CID 65119060

IUPAC4-hydroxy-N-[(1-hydroxy-4-methylcyclohexyl)methyl]benzamide
SMILESCC1CCC(O)(CNC(=O)c2ccc(O)cc2)CC1
InChIInChI=1S/C15H21NO3/c1-11-6-8-15(19,9-7-11)10-16-14(18)12-2-4-13(17)5-3-12/h2-5,11,17,19H,6-10H2,1H3,(H,16,18)
InChIKeyQKFOISWXVZVDTO-UHFFFAOYSA-N
MW263.34 g/mol
LogP2.06
Rot. Bonds3

About 4-hydroxy-N-[(1-hydroxy-4-methylcyclohexyl)methyl]benzamide

4-hydroxy-N-[(1-hydroxy-4-methylcyclohexyl)methyl]benzamide (PubChem CID 65119060) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is 4-hydroxy-N-[(1-hydroxy-4-methylcyclohexyl)methyl]benzamide.

Molecular Properties

Compound Name4-hydroxy-N-[(1-hydroxy-4-methylcyclohexyl)methyl]benzamide
PubChem CID65119060
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC Name4-hydroxy-N-[(1-hydroxy-4-methylcyclohexyl)methyl]benzamide
SMILESCC1CCC(O)(CNC(=O)c2ccc(O)cc2)CC1
InChIInChI=1S/C15H21NO3/c1-11-6-8-15(19,9-7-11)10-16-14(18)12-2-4-13(17)5-3-12/h2-5,11,17,19H,6-10H2,1H3,(H,16,18)
InChIKeyQKFOISWXVZVDTO-UHFFFAOYSA-N
XLogP2.06
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 52.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-hydroxy-4-methylcyclohexyl)methyl]-4-methoxybenzamide
CID 65119825
4-hydroxy-N-[(1-hydroxycycloheptyl)methyl]benzamide
CID 65123054
6-bromo-N-[(1-hydroxy-4-methylcyclohexyl)methyl]pyridine-3-carboxamide
CID 66464153
2-chloro-5-hydroxy-N-[(1-hydroxy-4-methylcyclohexyl)methyl]benzamide
CID 106502468
N-[(1-hydroxy-4-methylcyclohexyl)methyl]-6-methoxypyridine-3-carboxamide
CID 65120212
2-chloro-N-[(1-hydroxy-4-methylcyclohexyl)methyl]pyridine-4-carboxamide
CID 65118691
N-[(1-hydroxy-4-methylcyclohexyl)methyl]-1H-indazole-6-carboxamide
CID 65119013
4-bromo-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]benzamide
CID 65124189
N-[(1-hydroxy-4-methylcyclohexyl)methyl]-5-methylthiophene-2-carboxamide
CID 65118919
4-N-[(1-hydroxy-3-methylcyclohexyl)methyl]benzene-1,4-dicarboxamide
CID 65123811
5-chloro-2-hydroxy-N-[(1-hydroxy-4-methylcyclohexyl)methyl]benzamide
CID 65119441
4-chloro-2-fluoro-N-[(1-hydroxy-4-methylcyclohexyl)methyl]benzamide
CID 65119892

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-[(1-hydroxy-4-methylcyclohexyl)methyl]benzamide?
The IUPAC name of 4-hydroxy-N-[(1-hydroxy-4-methylcyclohexyl)methyl]benzamide (CID 65119060) is 4-hydroxy-N-[(1-hydroxy-4-methylcyclohexyl)methyl]benzamide.
What is the SMILES notation for 4-hydroxy-N-[(1-hydroxy-4-methylcyclohexyl)methyl]benzamide?
The canonical SMILES for 4-hydroxy-N-[(1-hydroxy-4-methylcyclohexyl)methyl]benzamide is CC1CCC(O)(CNC(=O)c2ccc(O)cc2)CC1.
What is the InChIKey of 4-hydroxy-N-[(1-hydroxy-4-methylcyclohexyl)methyl]benzamide?
The InChIKey is QKFOISWXVZVDTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-11-6-8-15(19,9-7-11)10-16-14(18)12-2-4-13(17)5-3-12/h2-5,11,17,19H,6-10H2,1H3,(H,16,18).
What are the key properties of 4-hydroxy-N-[(1-hydroxy-4-methylcyclohexyl)methyl]benzamide?
4-hydroxy-N-[(1-hydroxy-4-methylcyclohexyl)methyl]benzamide has a molecular weight of 263.34 g/mol, XLogP of 2.06, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-[(1-hydroxy-4-methylcyclohexyl)methyl]benzamide is sourced from PubChem (CID 65119060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).