N,1-dibenzyl-4-(1-hydroxycyclopentyl)-2,5-dioxopyrrolidine-3-carboxamide

C24H26N2O4 — CID 658694

IUPACN,1-dibenzyl-4-(1-hydroxycyclopentyl)-2,5-dioxopyrrolidine-3-carboxamide
SMILESO=C(NCc1ccccc1)C1C(=O)N(Cc2ccccc2)C(=O)C1C1(O)CCCC1
InChIInChI=1S/C24H26N2O4/c27-21(25-15-17-9-3-1-4-10-17)19-20(24(30)13-7-8-14-24)23(29)26(22(19)28)16-18-11-5-2-6-12-18/h1-6,9-12,19-20,30H,7-8,13-16H2,(H,25,27)
InChIKeyAZLBELZNTLQDJJ-UHFFFAOYSA-N
MW406.48 g/mol
LogP2.41
Rot. Bonds6

About N,1-dibenzyl-4-(1-hydroxycyclopentyl)-2,5-dioxopyrrolidine-3-carboxamide

N,1-dibenzyl-4-(1-hydroxycyclopentyl)-2,5-dioxopyrrolidine-3-carboxamide (PubChem CID 658694) has the molecular formula C24H26N2O4 and a molecular weight of 406.48 g/mol. Its IUPAC name is N,1-dibenzyl-4-(1-hydroxycyclopentyl)-2,5-dioxopyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN,1-dibenzyl-4-(1-hydroxycyclopentyl)-2,5-dioxopyrrolidine-3-carboxamide
PubChem CID658694
Molecular FormulaC24H26N2O4
Molecular Weight406.48 g/mol
Exact Mass406.19
IUPAC NameN,1-dibenzyl-4-(1-hydroxycyclopentyl)-2,5-dioxopyrrolidine-3-carboxamide
SMILESO=C(NCc1ccccc1)C1C(=O)N(Cc2ccccc2)C(=O)C1C1(O)CCCC1
InChIInChI=1S/C24H26N2O4/c27-21(25-15-17-9-3-1-4-10-17)19-20(24(30)13-7-8-14-24)23(29)26(22(19)28)16-18-11-5-2-6-12-18/h1-6,9-12,19-20,30H,7-8,13-16H2,(H,25,27)
InChIKeyAZLBELZNTLQDJJ-UHFFFAOYSA-N
XLogP2.41
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.48
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze N,1-dibenzyl-4-(1-hydroxycyclopentyl)-2,5-dioxopyrrolidine-3-carboxamide 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

3-benzyl-6-methyl-2,4-dioxo-3-azabicyclo[3.1.0]hexane-6-carboxylic acid
CID 82380265
(4S,5S)-4-N,5-N,1,3-tetrabenzyl-2-oxoimidazolidine-4,5-dicarboxamide
CID 98456274
N-benzylcyclobutanecarboxamide
CID 730128
N-benzylcyclopentanecarboxamide
CID 835634
(7Z)-N,1-dibenzyl-2-oxo-8-phenyl-3,4,5,6-tetrahydroazocine-6-carboxamide
CID 23631435
N-benzyl-2-oxo-1-oxaspiro[4.5]decane-4-carboxamide
CID 3077984
(3R,4R)-1-benzyl-3,4-dihydroxypyrrolidine-2,5-dione
CID 729946
methyl 3-benzyl-2,4-dioxo-3-azabicyclo[3.1.0]hexane-6-carboxylate
CID 134346997
2-[(2S)-4-benzyl-3,5-dioxo-1,4-diazaspiro[5.5]undecan-2-yl]acetic acid
CID 11324976
N,1-dibenzylpiperidine-3-carboxamide
CID 43918745
(2R,5S)-N,3-dibenzyl-4-oxo-3,10-diazatricyclo[5.2.1.01,5]decane-2-carboxamide
CID 177279997
N,1-dibenzyl-5-ethylpyrrolidine-2-carboxamide
CID 77403412

Frequently Asked Questions

What is the IUPAC name of N,1-dibenzyl-4-(1-hydroxycyclopentyl)-2,5-dioxopyrrolidine-3-carboxamide?
The IUPAC name of N,1-dibenzyl-4-(1-hydroxycyclopentyl)-2,5-dioxopyrrolidine-3-carboxamide (CID 658694) is N,1-dibenzyl-4-(1-hydroxycyclopentyl)-2,5-dioxopyrrolidine-3-carboxamide.
What is the SMILES notation for N,1-dibenzyl-4-(1-hydroxycyclopentyl)-2,5-dioxopyrrolidine-3-carboxamide?
The canonical SMILES for N,1-dibenzyl-4-(1-hydroxycyclopentyl)-2,5-dioxopyrrolidine-3-carboxamide is O=C(NCc1ccccc1)C1C(=O)N(Cc2ccccc2)C(=O)C1C1(O)CCCC1.
What is the InChIKey of N,1-dibenzyl-4-(1-hydroxycyclopentyl)-2,5-dioxopyrrolidine-3-carboxamide?
The InChIKey is AZLBELZNTLQDJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O4/c27-21(25-15-17-9-3-1-4-10-17)19-20(24(30)13-7-8-14-24)23(29)26(22(19)28)16-18-11-5-2-6-12-18/h1-6,9-12,19-20,30H,7-8,13-16H2,(H,25,27).
What are the key properties of N,1-dibenzyl-4-(1-hydroxycyclopentyl)-2,5-dioxopyrrolidine-3-carboxamide?
N,1-dibenzyl-4-(1-hydroxycyclopentyl)-2,5-dioxopyrrolidine-3-carboxamide has a molecular weight of 406.48 g/mol, XLogP of 2.41, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dibenzyl-4-(1-hydroxycyclopentyl)-2,5-dioxopyrrolidine-3-carboxamide is sourced from PubChem (CID 658694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).