2-[[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl]amino]-N-cyclopropylbenzamide

C24H28N4O3 — CID 18144272

IUPAC2-[[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl]amino]-N-cyclopropylbenzamide
SMILESO=C(CNc1ccccc1C(=O)NC1CC1)Nc1ccccc1C(=O)NC1CCCC1
InChIInChI=1S/C24H28N4O3/c29-22(15-25-20-11-5-3-9-18(20)23(30)27-17-13-14-17)28-21-12-6-4-10-19(21)24(31)26-16-7-1-2-8-16/h3-6,9-12,16-17,25H,1-2,7-8,13-15H2,(H,26,31)(H,27,30)(H,28,29)
InChIKeyGQHCBCGLNCNUFT-UHFFFAOYSA-N
MW420.51 g/mol
LogP3.30
Rot. Bonds8

About 2-[[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl]amino]-N-cyclopropylbenzamide

2-[[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl]amino]-N-cyclopropylbenzamide (PubChem CID 18144272) has the molecular formula C24H28N4O3 and a molecular weight of 420.51 g/mol. Its IUPAC name is 2-[[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl]amino]-N-cyclopropylbenzamide.

Molecular Properties

Compound Name2-[[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl]amino]-N-cyclopropylbenzamide
PubChem CID18144272
Molecular FormulaC24H28N4O3
Molecular Weight420.51 g/mol
Exact Mass420.22
IUPAC Name2-[[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl]amino]-N-cyclopropylbenzamide
SMILESO=C(CNc1ccccc1C(=O)NC1CC1)Nc1ccccc1C(=O)NC1CCCC1
InChIInChI=1S/C24H28N4O3/c29-22(15-25-20-11-5-3-9-18(20)23(30)27-17-13-14-17)28-21-12-6-4-10-19(21)24(31)26-16-7-1-2-8-16/h3-6,9-12,16-17,25H,1-2,7-8,13-15H2,(H,26,31)(H,27,30)(H,28,29)
InChIKeyGQHCBCGLNCNUFT-UHFFFAOYSA-N
XLogP3.30
TPSA99.33 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.51
LogP ≤ 53.30
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-2-[[2-(2,5-difluoroanilino)acetyl]amino]benzamide
CID 33162764
N-cyclopropyl-2-[[2-(2,5-dimethylanilino)acetyl]amino]benzamide
CID 17498144
N-cyclopropyl-2-[[2-oxo-2-(4-phenylanilino)ethyl]amino]benzamide
CID 24614903
N-cyclopropyl-2-[[2-oxo-2-(2-phenoxyanilino)ethyl]amino]benzamide
CID 18144260
2-[(2-cyclohexylacetyl)amino]-N-cyclopropylbenzamide
CID 34280929
N-cyclopentyl-2-[[2-(2-methylphenyl)acetyl]amino]benzamide
CID 17476217
2-[[2-(4-carbamoylanilino)acetyl]amino]-N-cyclopropylbenzamide
CID 78793094
N-cyclopropyl-2-[[2-oxo-2-(propylamino)ethyl]amino]benzamide
CID 32906957
N-cyclopentyl-2-[(2-methylsulfanylacetyl)amino]benzamide
CID 26084225
2-[[2-[4-(cyclohexylcarbamoyl)anilino]-2-oxoethyl]amino]benzamide
CID 54811917
4-chloro-2-[[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl]amino]-N-propylbenzamide
CID 55917777
N-cyclopentyl-2-[[2-[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]acetyl]amino]benzamide
CID 9053688

Frequently Asked Questions

What is the IUPAC name of 2-[[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl]amino]-N-cyclopropylbenzamide?
The IUPAC name of 2-[[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl]amino]-N-cyclopropylbenzamide (CID 18144272) is 2-[[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl]amino]-N-cyclopropylbenzamide.
What is the SMILES notation for 2-[[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl]amino]-N-cyclopropylbenzamide?
The canonical SMILES for 2-[[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl]amino]-N-cyclopropylbenzamide is O=C(CNc1ccccc1C(=O)NC1CC1)Nc1ccccc1C(=O)NC1CCCC1.
What is the InChIKey of 2-[[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl]amino]-N-cyclopropylbenzamide?
The InChIKey is GQHCBCGLNCNUFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N4O3/c29-22(15-25-20-11-5-3-9-18(20)23(30)27-17-13-14-17)28-21-12-6-4-10-19(21)24(31)26-16-7-1-2-8-16/h3-6,9-12,16-17,25H,1-2,7-8,13-15H2,(H,26,31)(H,27,30)(H,28,29).
What are the key properties of 2-[[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl]amino]-N-cyclopropylbenzamide?
2-[[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl]amino]-N-cyclopropylbenzamide has a molecular weight of 420.51 g/mol, XLogP of 3.30, 8 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl]amino]-N-cyclopropylbenzamide is sourced from PubChem (CID 18144272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).