N-[1-oxo-1-[3-[(2-oxopyrrolidin-1-yl)methyl]anilino]propan-2-yl]cyclopentanecarboxamide

C20H27N3O3 — CID 51119825

IUPACN-[1-oxo-1-[3-[(2-oxopyrrolidin-1-yl)methyl]anilino]propan-2-yl]cyclopentanecarboxamide
SMILESCC(NC(=O)C1CCCC1)C(=O)Nc1cccc(CN2CCCC2=O)c1
InChIInChI=1S/C20H27N3O3/c1-14(21-20(26)16-7-2-3-8-16)19(25)22-17-9-4-6-15(12-17)13-23-11-5-10-18(23)24/h4,6,9,12,14,16H,2-3,5,7-8,10-11,13H2,1H3,(H,21,26)(H,22,25)
InChIKeyANOTUJOTWPETCZ-UHFFFAOYSA-N
MW357.45 g/mol
LogP2.44
Rot. Bonds6

About N-[1-oxo-1-[3-[(2-oxopyrrolidin-1-yl)methyl]anilino]propan-2-yl]cyclopentanecarboxamide

N-[1-oxo-1-[3-[(2-oxopyrrolidin-1-yl)methyl]anilino]propan-2-yl]cyclopentanecarboxamide (PubChem CID 51119825) has the molecular formula C20H27N3O3 and a molecular weight of 357.45 g/mol. Its IUPAC name is N-[1-oxo-1-[3-[(2-oxopyrrolidin-1-yl)methyl]anilino]propan-2-yl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[1-oxo-1-[3-[(2-oxopyrrolidin-1-yl)methyl]anilino]propan-2-yl]cyclopentanecarboxamide
PubChem CID51119825
Molecular FormulaC20H27N3O3
Molecular Weight357.45 g/mol
Exact Mass357.21
IUPAC NameN-[1-oxo-1-[3-[(2-oxopyrrolidin-1-yl)methyl]anilino]propan-2-yl]cyclopentanecarboxamide
SMILESCC(NC(=O)C1CCCC1)C(=O)Nc1cccc(CN2CCCC2=O)c1
InChIInChI=1S/C20H27N3O3/c1-14(21-20(26)16-7-2-3-8-16)19(25)22-17-9-4-6-15(12-17)13-23-11-5-10-18(23)24/h4,6,9,12,14,16H,2-3,5,7-8,10-11,13H2,1H3,(H,21,26)(H,22,25)
InChIKeyANOTUJOTWPETCZ-UHFFFAOYSA-N
XLogP2.44
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.45
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[1-oxo-1-[3-[(2-oxopyrrolidin-1-yl)methyl]anilino]propan-2-yl]cyclopentanecarboxamide 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

N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]-2-phenoxypropanamide
CID 46600220
2-amino-2-methyl-N-[3-[(2-oxopiperidin-1-yl)methyl]phenyl]propanamide;hydrochloride
CID 119309661
N-[(2R)-1-anilino-1-oxopropan-2-yl]cyclohexanecarboxamide
CID 94194364
1-[(2R)-heptan-2-yl]-3-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]urea
CID 94784827
1-(1-acetylpiperidin-4-yl)-3-[3-[(2-oxopiperidin-1-yl)methyl]phenyl]urea
CID 128960283
N-[3-[[(2S)-2-methylpiperidin-1-yl]methyl]phenyl]-3-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 92627414
3-methyl-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]but-2-enamide
CID 30875155
N-(2-bromo-4-methylphenyl)-2-[3-[(2-oxopyrrolidin-1-yl)methyl]anilino]propanamide
CID 55598286
1-[1-(2-methylphenyl)ethyl]-3-[3-[(2-oxopiperidin-1-yl)methyl]phenyl]urea
CID 60614486
1-(4-methylphenyl)-3-[3-[(2-oxopiperidin-1-yl)methyl]phenyl]urea
CID 49470702
N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]hexanamide
CID 37359459
(3aS,6aS)-N-[3-[(2-oxopiperidin-1-yl)methyl]phenyl]-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole-1-carboxamide
CID 99778301

Frequently Asked Questions

What is the IUPAC name of N-[1-oxo-1-[3-[(2-oxopyrrolidin-1-yl)methyl]anilino]propan-2-yl]cyclopentanecarboxamide?
The IUPAC name of N-[1-oxo-1-[3-[(2-oxopyrrolidin-1-yl)methyl]anilino]propan-2-yl]cyclopentanecarboxamide (CID 51119825) is N-[1-oxo-1-[3-[(2-oxopyrrolidin-1-yl)methyl]anilino]propan-2-yl]cyclopentanecarboxamide.
What is the SMILES notation for N-[1-oxo-1-[3-[(2-oxopyrrolidin-1-yl)methyl]anilino]propan-2-yl]cyclopentanecarboxamide?
The canonical SMILES for N-[1-oxo-1-[3-[(2-oxopyrrolidin-1-yl)methyl]anilino]propan-2-yl]cyclopentanecarboxamide is CC(NC(=O)C1CCCC1)C(=O)Nc1cccc(CN2CCCC2=O)c1.
What is the InChIKey of N-[1-oxo-1-[3-[(2-oxopyrrolidin-1-yl)methyl]anilino]propan-2-yl]cyclopentanecarboxamide?
The InChIKey is ANOTUJOTWPETCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O3/c1-14(21-20(26)16-7-2-3-8-16)19(25)22-17-9-4-6-15(12-17)13-23-11-5-10-18(23)24/h4,6,9,12,14,16H,2-3,5,7-8,10-11,13H2,1H3,(H,21,26)(H,22,25).
What are the key properties of N-[1-oxo-1-[3-[(2-oxopyrrolidin-1-yl)methyl]anilino]propan-2-yl]cyclopentanecarboxamide?
N-[1-oxo-1-[3-[(2-oxopyrrolidin-1-yl)methyl]anilino]propan-2-yl]cyclopentanecarboxamide has a molecular weight of 357.45 g/mol, XLogP of 2.44, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-oxo-1-[3-[(2-oxopyrrolidin-1-yl)methyl]anilino]propan-2-yl]cyclopentanecarboxamide is sourced from PubChem (CID 51119825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).