4-(cyclohexanecarbonylamino)-N-propylbenzamide

C17H24N2O2 — CID 17218748

IUPAC4-(cyclohexanecarbonylamino)-N-propylbenzamide
SMILESCCCNC(=O)c1ccc(NC(=O)C2CCCCC2)cc1
InChIInChI=1S/C17H24N2O2/c1-2-12-18-16(20)14-8-10-15(11-9-14)19-17(21)13-6-4-3-5-7-13/h8-11,13H,2-7,12H2,1H3,(H,18,20)(H,19,21)
InChIKeyODCQJPTWLKMANB-UHFFFAOYSA-N
MW288.39 g/mol
LogP3.35
Rot. Bonds5

About 4-(cyclohexanecarbonylamino)-N-propylbenzamide

4-(cyclohexanecarbonylamino)-N-propylbenzamide (PubChem CID 17218748) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 4-(cyclohexanecarbonylamino)-N-propylbenzamide.

Molecular Properties

Compound Name4-(cyclohexanecarbonylamino)-N-propylbenzamide
PubChem CID17218748
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name4-(cyclohexanecarbonylamino)-N-propylbenzamide
SMILESCCCNC(=O)c1ccc(NC(=O)C2CCCCC2)cc1
InChIInChI=1S/C17H24N2O2/c1-2-12-18-16(20)14-8-10-15(11-9-14)19-17(21)13-6-4-3-5-7-13/h8-11,13H,2-7,12H2,1H3,(H,18,20)(H,19,21)
InChIKeyODCQJPTWLKMANB-UHFFFAOYSA-N
XLogP3.35
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(cyclopentanecarbonylamino)-N-[2-(propanoylamino)ethyl]benzamide
CID 121062258
N-[4-(propylcarbamoyl)phenyl]piperidine-3-carboxamide;hydrochloride
CID 119297921
4-(cyclohexylcarbamoylamino)-N-propylbenzamide
CID 17180771
N-[2-(tert-butylcarbamoylamino)ethyl]-4-(cyclopentanecarbonylamino)benzamide
CID 121063312
N-[2-[(4-tert-butylphenyl)carbamoylamino]ethyl]-4-(cyclopentanecarbonylamino)benzamide
CID 121063342
4-(cyclohexanecarbonylamino)-N,N-dipropylbenzamide
CID 17196139
1-N,4-N-bis[4-(propylcarbamoyl)phenyl]benzene-1,4-dicarboxamide
CID 17219360
4-(cyclobutanecarbonylamino)-N-(2-methylpropyl)benzamide
CID 47309837
4-(cyclopentanecarbonylamino)-N-[2-[(2-methylphenyl)carbamoylamino]ethyl]benzamide
CID 121063331
N-[4-(methylaminocarbamoyl)phenyl]cyclobutanecarboxamide
CID 177007541
N-[4-(cyclopropanecarbonylamino)phenyl]cyclohexanecarboxamide
CID 25276011
4-N-cyclopentyl-1-N-propylbenzene-1,4-dicarboxamide
CID 109042876

Frequently Asked Questions

What is the IUPAC name of 4-(cyclohexanecarbonylamino)-N-propylbenzamide?
The IUPAC name of 4-(cyclohexanecarbonylamino)-N-propylbenzamide (CID 17218748) is 4-(cyclohexanecarbonylamino)-N-propylbenzamide.
What is the SMILES notation for 4-(cyclohexanecarbonylamino)-N-propylbenzamide?
The canonical SMILES for 4-(cyclohexanecarbonylamino)-N-propylbenzamide is CCCNC(=O)c1ccc(NC(=O)C2CCCCC2)cc1.
What is the InChIKey of 4-(cyclohexanecarbonylamino)-N-propylbenzamide?
The InChIKey is ODCQJPTWLKMANB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-2-12-18-16(20)14-8-10-15(11-9-14)19-17(21)13-6-4-3-5-7-13/h8-11,13H,2-7,12H2,1H3,(H,18,20)(H,19,21).
What are the key properties of 4-(cyclohexanecarbonylamino)-N-propylbenzamide?
4-(cyclohexanecarbonylamino)-N-propylbenzamide has a molecular weight of 288.39 g/mol, XLogP of 3.35, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclohexanecarbonylamino)-N-propylbenzamide is sourced from PubChem (CID 17218748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).