4-N-cyclopentyl-1-N-propylbenzene-1,4-dicarboxamide

C16H22N2O2 — CID 109042876

IUPAC4-N-cyclopentyl-1-N-propylbenzene-1,4-dicarboxamide
SMILESCCCNC(=O)c1ccc(C(=O)NC2CCCC2)cc1
InChIInChI=1S/C16H22N2O2/c1-2-11-17-15(19)12-7-9-13(10-8-12)16(20)18-14-5-3-4-6-14/h7-10,14H,2-6,11H2,1H3,(H,17,19)(H,18,20)
InChIKeyUQXRNCATTRIZLL-UHFFFAOYSA-N
MW274.36 g/mol
LogP2.50
Rot. Bonds5

About 4-N-cyclopentyl-1-N-propylbenzene-1,4-dicarboxamide

4-N-cyclopentyl-1-N-propylbenzene-1,4-dicarboxamide (PubChem CID 109042876) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is 4-N-cyclopentyl-1-N-propylbenzene-1,4-dicarboxamide.

Molecular Properties

Compound Name4-N-cyclopentyl-1-N-propylbenzene-1,4-dicarboxamide
PubChem CID109042876
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Name4-N-cyclopentyl-1-N-propylbenzene-1,4-dicarboxamide
SMILESCCCNC(=O)c1ccc(C(=O)NC2CCCC2)cc1
InChIInChI=1S/C16H22N2O2/c1-2-11-17-15(19)12-7-9-13(10-8-12)16(20)18-14-5-3-4-6-14/h7-10,14H,2-6,11H2,1H3,(H,17,19)(H,18,20)
InChIKeyUQXRNCATTRIZLL-UHFFFAOYSA-N
XLogP2.50
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-N-cyclopentyl-1-N-propylbenzene-1,4-dicarboxamide 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-(cyclohexylcarbamoylamino)-N-propylbenzamide
CID 17180771
N-cyclooctyl-4-(propylamino)benzamide
CID 62172072
5-N-cyclohexyl-3-N-propylpyridine-3,5-dicarboxamide
CID 109101138
4-N-cycloheptyl-1-N-[2-(dimethylamino)ethyl]benzene-1,4-dicarboxamide
CID 109045756
N-cyclobutyl-4-(propylamino)benzamide
CID 55067083
4-butyl-N-cyclopentylbenzamide
CID 60674795
N-cyclohexyl-4-propoxybenzamide
CID 4938429
N-cyclooctyl-4-methylbenzamide
CID 3995245
4-butoxy-N-cyclobutylbenzamide
CID 71449411
4-N-cycloheptyl-1-N-prop-2-enylbenzene-1,4-dicarboxamide
CID 109043526
1-N-[2-(4-chlorophenyl)ethyl]-4-N-cyclopentylbenzene-1,4-dicarboxamide
CID 109044439
4-(cyclohexanecarbonylamino)-N-propylbenzamide
CID 17218748

Frequently Asked Questions

What is the IUPAC name of 4-N-cyclopentyl-1-N-propylbenzene-1,4-dicarboxamide?
The IUPAC name of 4-N-cyclopentyl-1-N-propylbenzene-1,4-dicarboxamide (CID 109042876) is 4-N-cyclopentyl-1-N-propylbenzene-1,4-dicarboxamide.
What is the SMILES notation for 4-N-cyclopentyl-1-N-propylbenzene-1,4-dicarboxamide?
The canonical SMILES for 4-N-cyclopentyl-1-N-propylbenzene-1,4-dicarboxamide is CCCNC(=O)c1ccc(C(=O)NC2CCCC2)cc1.
What is the InChIKey of 4-N-cyclopentyl-1-N-propylbenzene-1,4-dicarboxamide?
The InChIKey is UQXRNCATTRIZLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-2-11-17-15(19)12-7-9-13(10-8-12)16(20)18-14-5-3-4-6-14/h7-10,14H,2-6,11H2,1H3,(H,17,19)(H,18,20).
What are the key properties of 4-N-cyclopentyl-1-N-propylbenzene-1,4-dicarboxamide?
4-N-cyclopentyl-1-N-propylbenzene-1,4-dicarboxamide has a molecular weight of 274.36 g/mol, XLogP of 2.50, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-cyclopentyl-1-N-propylbenzene-1,4-dicarboxamide is sourced from PubChem (CID 109042876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).