3-(cyclohexanecarbonylamino)-N-(2-hydroxypropyl)benzamide

C17H24N2O3 — CID 78866245

IUPAC3-(cyclohexanecarbonylamino)-N-(2-hydroxypropyl)benzamide
SMILESCC(O)CNC(=O)c1cccc(NC(=O)C2CCCCC2)c1
InChIInChI=1S/C17H24N2O3/c1-12(20)11-18-16(21)14-8-5-9-15(10-14)19-17(22)13-6-3-2-4-7-13/h5,8-10,12-13,20H,2-4,6-7,11H2,1H3,(H,18,21)(H,19,22)
InChIKeyZJCRWCRKMAUXDN-UHFFFAOYSA-N
MW304.39 g/mol
LogP2.32
Rot. Bonds5

About 3-(cyclohexanecarbonylamino)-N-(2-hydroxypropyl)benzamide

3-(cyclohexanecarbonylamino)-N-(2-hydroxypropyl)benzamide (PubChem CID 78866245) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is 3-(cyclohexanecarbonylamino)-N-(2-hydroxypropyl)benzamide.

Molecular Properties

Compound Name3-(cyclohexanecarbonylamino)-N-(2-hydroxypropyl)benzamide
PubChem CID78866245
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC Name3-(cyclohexanecarbonylamino)-N-(2-hydroxypropyl)benzamide
SMILESCC(O)CNC(=O)c1cccc(NC(=O)C2CCCCC2)c1
InChIInChI=1S/C17H24N2O3/c1-12(20)11-18-16(21)14-8-5-9-15(10-14)19-17(22)13-6-3-2-4-7-13/h5,8-10,12-13,20H,2-4,6-7,11H2,1H3,(H,18,21)(H,19,22)
InChIKeyZJCRWCRKMAUXDN-UHFFFAOYSA-N
XLogP2.32
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 52.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-(cyclopropanecarbonylamino)-N-(2-methylpropyl)benzamide
CID 40603945
N-[(2S)-butan-2-yl]-3-(cyclohexanecarbonylamino)benzamide
CID 42427444
3-(cyclohexanecarbonylamino)-N-(1-hydroxypropan-2-yl)benzamide
CID 78866259
3-(cyclohexanecarbonylamino)-N-(2-methoxyethyl)benzamide
CID 17218956
3-(cyclohexanecarbonylamino)-N-[2-(ethylamino)ethyl]benzamide
CID 119508589
N-[(3-acetamidophenyl)methyl]-3-(cyclohexanecarbonylamino)benzamide
CID 39575427
3-[[3-(cyclohexanecarbonylamino)benzoyl]amino]-2,2-dimethylpropanoic acid
CID 75429563
N-(2-hydroxypropyl)-3-(propan-2-ylcarbamoylamino)benzamide
CID 78869572
3-(cyclopropanecarbonylamino)-N-propan-2-ylbenzamide
CID 17197396
3-(cyclopropanecarbonylamino)-N-(3-hydroxy-4-methylpentyl)benzamide
CID 111460763
3-(cyclohexanecarbonylamino)-N-methoxybenzamide
CID 38039849
3-(cyclohexanecarbonylamino)-N-(3-phenylprop-2-ynyl)benzamide
CID 55651913

Frequently Asked Questions

What is the IUPAC name of 3-(cyclohexanecarbonylamino)-N-(2-hydroxypropyl)benzamide?
The IUPAC name of 3-(cyclohexanecarbonylamino)-N-(2-hydroxypropyl)benzamide (CID 78866245) is 3-(cyclohexanecarbonylamino)-N-(2-hydroxypropyl)benzamide.
What is the SMILES notation for 3-(cyclohexanecarbonylamino)-N-(2-hydroxypropyl)benzamide?
The canonical SMILES for 3-(cyclohexanecarbonylamino)-N-(2-hydroxypropyl)benzamide is CC(O)CNC(=O)c1cccc(NC(=O)C2CCCCC2)c1.
What is the InChIKey of 3-(cyclohexanecarbonylamino)-N-(2-hydroxypropyl)benzamide?
The InChIKey is ZJCRWCRKMAUXDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-12(20)11-18-16(21)14-8-5-9-15(10-14)19-17(22)13-6-3-2-4-7-13/h5,8-10,12-13,20H,2-4,6-7,11H2,1H3,(H,18,21)(H,19,22).
What are the key properties of 3-(cyclohexanecarbonylamino)-N-(2-hydroxypropyl)benzamide?
3-(cyclohexanecarbonylamino)-N-(2-hydroxypropyl)benzamide has a molecular weight of 304.39 g/mol, XLogP of 2.32, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclohexanecarbonylamino)-N-(2-hydroxypropyl)benzamide is sourced from PubChem (CID 78866245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).