3-(2-hydroxypropan-2-yl)-N-(2-methylcyclohexyl)benzamide

C17H25NO2 — CID 110486141

IUPAC3-(2-hydroxypropan-2-yl)-N-(2-methylcyclohexyl)benzamide
SMILESCC1CCCCC1NC(=O)c1cccc(C(C)(C)O)c1
InChIInChI=1S/C17H25NO2/c1-12-7-4-5-10-15(12)18-16(19)13-8-6-9-14(11-13)17(2,3)20/h6,8-9,11-12,15,20H,4-5,7,10H2,1-3H3,(H,18,19)
InChIKeyFYWLUWMIOQLNFV-UHFFFAOYSA-N
MW275.39 g/mol
LogP3.22
Rot. Bonds3

About 3-(2-hydroxypropan-2-yl)-N-(2-methylcyclohexyl)benzamide

3-(2-hydroxypropan-2-yl)-N-(2-methylcyclohexyl)benzamide (PubChem CID 110486141) has the molecular formula C17H25NO2 and a molecular weight of 275.39 g/mol. Its IUPAC name is 3-(2-hydroxypropan-2-yl)-N-(2-methylcyclohexyl)benzamide.

Molecular Properties

Compound Name3-(2-hydroxypropan-2-yl)-N-(2-methylcyclohexyl)benzamide
PubChem CID110486141
Molecular FormulaC17H25NO2
Molecular Weight275.39 g/mol
Exact Mass275.19
IUPAC Name3-(2-hydroxypropan-2-yl)-N-(2-methylcyclohexyl)benzamide
SMILESCC1CCCCC1NC(=O)c1cccc(C(C)(C)O)c1
InChIInChI=1S/C17H25NO2/c1-12-7-4-5-10-15(12)18-16(19)13-8-6-9-14(11-13)17(2,3)20/h6,8-9,11-12,15,20H,4-5,7,10H2,1-3H3,(H,18,19)
InChIKeyFYWLUWMIOQLNFV-UHFFFAOYSA-N
XLogP3.22
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-(2-hydroxypropan-2-yl)-N-(2-methylcyclohexyl)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

3-methyl-N-[(1S,2S)-2-methylcyclohexyl]benzamide
CID 848103
N-[(1R)-2-methylcyclohexyl]benzamide
CID 137472316
1-N,4-N-bis[(1S,2R)-2-methylcyclohexyl]benzene-1,4-dicarboxamide
CID 124805645
3-(chloromethyl)-N-(2-methylcyclohexyl)benzamide
CID 43333330
3-cyano-N-[(1S,2R)-2-methylcyclohexyl]benzamide
CID 9404837
3-(difluoromethoxy)-N-[(1R,2R)-2-methylcyclohexyl]benzamide
CID 51537876
N-(2-methylcyclohexyl)-3-(2-oxopyrrolidin-1-yl)benzamide
CID 4063191
3-(N'-hydroxycarbamimidoyl)-N-(2-methylcyclopentyl)benzamide
CID 76993606
N-[(1R,2S)-2-methylcyclohexyl]-3-[(4-methylphenyl)sulfamoyl]benzamide
CID 9164435
3-[methoxy(methyl)sulfamoyl]-N-[(1S,2S)-2-methylcyclohexyl]benzamide
CID 9273168
N-[(1R,2R)-2-methylcyclohexyl]-3-[(4-methylphenyl)sulfamoyl]benzamide
CID 9164433
N-(2-methylcyclohexyl)pyridine-3-carboxamide
CID 11841361

Frequently Asked Questions

What is the IUPAC name of 3-(2-hydroxypropan-2-yl)-N-(2-methylcyclohexyl)benzamide?
The IUPAC name of 3-(2-hydroxypropan-2-yl)-N-(2-methylcyclohexyl)benzamide (CID 110486141) is 3-(2-hydroxypropan-2-yl)-N-(2-methylcyclohexyl)benzamide.
What is the SMILES notation for 3-(2-hydroxypropan-2-yl)-N-(2-methylcyclohexyl)benzamide?
The canonical SMILES for 3-(2-hydroxypropan-2-yl)-N-(2-methylcyclohexyl)benzamide is CC1CCCCC1NC(=O)c1cccc(C(C)(C)O)c1.
What is the InChIKey of 3-(2-hydroxypropan-2-yl)-N-(2-methylcyclohexyl)benzamide?
The InChIKey is FYWLUWMIOQLNFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO2/c1-12-7-4-5-10-15(12)18-16(19)13-8-6-9-14(11-13)17(2,3)20/h6,8-9,11-12,15,20H,4-5,7,10H2,1-3H3,(H,18,19).
What are the key properties of 3-(2-hydroxypropan-2-yl)-N-(2-methylcyclohexyl)benzamide?
3-(2-hydroxypropan-2-yl)-N-(2-methylcyclohexyl)benzamide has a molecular weight of 275.39 g/mol, XLogP of 3.22, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-hydroxypropan-2-yl)-N-(2-methylcyclohexyl)benzamide is sourced from PubChem (CID 110486141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).