3-cyclohexyl-N-[1-(hydroxymethyl)-4-methylcyclohexyl]propanamide

C17H31NO2 — CID 62527693

IUPAC3-cyclohexyl-N-[1-(hydroxymethyl)-4-methylcyclohexyl]propanamide
SMILESCC1CCC(CO)(NC(=O)CCC2CCCCC2)CC1
InChIInChI=1S/C17H31NO2/c1-14-9-11-17(13-19,12-10-14)18-16(20)8-7-15-5-3-2-4-6-15/h14-15,19H,2-13H2,1H3,(H,18,20)
InChIKeyYEDDEWHLSBVKNY-UHFFFAOYSA-N
MW281.44 g/mol
LogP3.40
Rot. Bonds5

About 3-cyclohexyl-N-[1-(hydroxymethyl)-4-methylcyclohexyl]propanamide

3-cyclohexyl-N-[1-(hydroxymethyl)-4-methylcyclohexyl]propanamide (PubChem CID 62527693) has the molecular formula C17H31NO2 and a molecular weight of 281.44 g/mol. Its IUPAC name is 3-cyclohexyl-N-[1-(hydroxymethyl)-4-methylcyclohexyl]propanamide.

Molecular Properties

Compound Name3-cyclohexyl-N-[1-(hydroxymethyl)-4-methylcyclohexyl]propanamide
PubChem CID62527693
Molecular FormulaC17H31NO2
Molecular Weight281.44 g/mol
Exact Mass281.24
IUPAC Name3-cyclohexyl-N-[1-(hydroxymethyl)-4-methylcyclohexyl]propanamide
SMILESCC1CCC(CO)(NC(=O)CCC2CCCCC2)CC1
InChIInChI=1S/C17H31NO2/c1-14-9-11-17(13-19,12-10-14)18-16(20)8-7-15-5-3-2-4-6-15/h14-15,19H,2-13H2,1H3,(H,18,20)
InChIKeyYEDDEWHLSBVKNY-UHFFFAOYSA-N
XLogP3.40
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.44
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-cyclohexyl-N-[1-(hydroxymethyl)-4-methylcyclohexyl]propanamide 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

3-cyclohexyl-N-[1-(hydroxymethyl)cyclopropyl]propanamide
CID 115764878
3-cyclohexyl-N-[1-(hydroxymethyl)cyclohexyl]propanamide
CID 62519861
3-cyclohexyl-N-[1-(hydroxymethyl)cyclopentyl]propanamide
CID 62517314
5-hydroxy-N-[1-(hydroxymethyl)-4-methylcyclohexyl]pentanamide
CID 79198654
N-[1-(hydroxymethyl)-4-methylcyclohexyl]decanamide
CID 63404095
N-[1-(chloromethyl)-3-methylcyclohexyl]-3-cyclopentylpropanamide
CID 114304094
2-[1-(3-cyclopentylpropanoylamino)cyclopentyl]acetic acid
CID 64671798
1-[(3-cyclopentylpropanoylamino)methyl]-4-methylcyclohexane-1-carboxylic acid
CID 115440979
1-(3-cyclohexylpropanoylamino)cyclopentane-1-carboxylic acid
CID 43329530
1-[2-[[1-(hydroxymethyl)-4-methylcyclohexyl]amino]-2-oxoethyl]cyclopentane-1-carboxylic acid
CID 62552996
2-cyclohexyl-N-[1-(hydroxymethyl)cyclopentyl]acetamide
CID 62518543
N-[1-(hydroxymethyl)-4-methylcyclohexyl]-2-(thian-4-yl)acetamide
CID 83135926

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-N-[1-(hydroxymethyl)-4-methylcyclohexyl]propanamide?
The IUPAC name of 3-cyclohexyl-N-[1-(hydroxymethyl)-4-methylcyclohexyl]propanamide (CID 62527693) is 3-cyclohexyl-N-[1-(hydroxymethyl)-4-methylcyclohexyl]propanamide.
What is the SMILES notation for 3-cyclohexyl-N-[1-(hydroxymethyl)-4-methylcyclohexyl]propanamide?
The canonical SMILES for 3-cyclohexyl-N-[1-(hydroxymethyl)-4-methylcyclohexyl]propanamide is CC1CCC(CO)(NC(=O)CCC2CCCCC2)CC1.
What is the InChIKey of 3-cyclohexyl-N-[1-(hydroxymethyl)-4-methylcyclohexyl]propanamide?
The InChIKey is YEDDEWHLSBVKNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31NO2/c1-14-9-11-17(13-19,12-10-14)18-16(20)8-7-15-5-3-2-4-6-15/h14-15,19H,2-13H2,1H3,(H,18,20).
What are the key properties of 3-cyclohexyl-N-[1-(hydroxymethyl)-4-methylcyclohexyl]propanamide?
3-cyclohexyl-N-[1-(hydroxymethyl)-4-methylcyclohexyl]propanamide has a molecular weight of 281.44 g/mol, XLogP of 3.40, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-N-[1-(hydroxymethyl)-4-methylcyclohexyl]propanamide is sourced from PubChem (CID 62527693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).