N-[2-(hydroxymethyl)cyclohexyl]benzamide

C14H19NO2 — CID 85447885

IUPACN-[2-(hydroxymethyl)cyclohexyl]benzamide
SMILESO=C(NC1CCCCC1CO)c1ccccc1
InChIInChI=1S/C14H19NO2/c16-10-12-8-4-5-9-13(12)15-14(17)11-6-2-1-3-7-11/h1-3,6-7,12-13,16H,4-5,8-10H2,(H,15,17)
InChIKeySBVMITIYFLLAQQ-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.97
Rot. Bonds3

About N-[2-(hydroxymethyl)cyclohexyl]benzamide

N-[2-(hydroxymethyl)cyclohexyl]benzamide (PubChem CID 85447885) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is N-[2-(hydroxymethyl)cyclohexyl]benzamide.

Molecular Properties

Compound NameN-[2-(hydroxymethyl)cyclohexyl]benzamide
PubChem CID85447885
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC NameN-[2-(hydroxymethyl)cyclohexyl]benzamide
SMILESO=C(NC1CCCCC1CO)c1ccccc1
InChIInChI=1S/C14H19NO2/c16-10-12-8-4-5-9-13(12)15-14(17)11-6-2-1-3-7-11/h1-3,6-7,12-13,16H,4-5,8-10H2,(H,15,17)
InChIKeySBVMITIYFLLAQQ-UHFFFAOYSA-N
XLogP1.97
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[2-(hydroxymethyl)cyclohexyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-N-[2-(hydroxymethyl)cyclohexyl]benzene-1,4-dicarboxamide
CID 103798607
N-[(1S,2R)-2-(aminomethyl)cyclopentyl]benzamide
CID 94903786
N-[2-(chloromethyl)cyclopentyl]benzamide
CID 106365726
3-bromo-N-[2-(hydroxymethyl)cyclohexyl]benzamide
CID 103798593
N-[(1S,2R)-2-aminocyclohexyl]benzamide
CID 15151854
N-[(1S,2S)-2-aminocyclohexyl]benzamide
CID 15151853
4-(chloromethyl)-N-[2-(hydroxymethyl)cyclohexyl]benzamide
CID 106359879
4-amino-N-[2-(hydroxymethyl)cyclopentyl]benzamide
CID 113266858
N-[2-(hydroxymethyl)cyclopentyl]pyridine-4-carboxamide
CID 103751246
N-[2-(hydroxymethyl)cyclohexyl]-2-sulfanylbenzamide
CID 106367893
2-amino-N-[2-(hydroxymethyl)cyclohexyl]benzamide
CID 103951112
N-[(3S,4S)-4-(hydroxymethyl)piperidin-3-yl]benzamide
CID 71836746

Frequently Asked Questions

What is the IUPAC name of N-[2-(hydroxymethyl)cyclohexyl]benzamide?
The IUPAC name of N-[2-(hydroxymethyl)cyclohexyl]benzamide (CID 85447885) is N-[2-(hydroxymethyl)cyclohexyl]benzamide.
What is the SMILES notation for N-[2-(hydroxymethyl)cyclohexyl]benzamide?
The canonical SMILES for N-[2-(hydroxymethyl)cyclohexyl]benzamide is O=C(NC1CCCCC1CO)c1ccccc1.
What is the InChIKey of N-[2-(hydroxymethyl)cyclohexyl]benzamide?
The InChIKey is SBVMITIYFLLAQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c16-10-12-8-4-5-9-13(12)15-14(17)11-6-2-1-3-7-11/h1-3,6-7,12-13,16H,4-5,8-10H2,(H,15,17).
What are the key properties of N-[2-(hydroxymethyl)cyclohexyl]benzamide?
N-[2-(hydroxymethyl)cyclohexyl]benzamide has a molecular weight of 233.31 g/mol, XLogP of 1.97, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(hydroxymethyl)cyclohexyl]benzamide is sourced from PubChem (CID 85447885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).