N-cyclopentyl-N'-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide

C17H21N3O3 — CID 30679166

IUPACN-cyclopentyl-N'-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide
SMILESO=C(Nc1ccc(N2CCCC2=O)cc1)C(=O)NC1CCCC1
InChIInChI=1S/C17H21N3O3/c21-15-6-3-11-20(15)14-9-7-13(8-10-14)19-17(23)16(22)18-12-4-1-2-5-12/h7-10,12H,1-6,11H2,(H,18,22)(H,19,23)
InChIKeyMQRZQRWANWBWPR-UHFFFAOYSA-N
MW315.37 g/mol
LogP1.81
Rot. Bonds3

About N-cyclopentyl-N'-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide

N-cyclopentyl-N'-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide (PubChem CID 30679166) has the molecular formula C17H21N3O3 and a molecular weight of 315.37 g/mol. Its IUPAC name is N-cyclopentyl-N'-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide.

Molecular Properties

Compound NameN-cyclopentyl-N'-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide
PubChem CID30679166
Molecular FormulaC17H21N3O3
Molecular Weight315.37 g/mol
Exact Mass315.16
IUPAC NameN-cyclopentyl-N'-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide
SMILESO=C(Nc1ccc(N2CCCC2=O)cc1)C(=O)NC1CCCC1
InChIInChI=1S/C17H21N3O3/c21-15-6-3-11-20(15)14-9-7-13(8-10-14)19-17(23)16(22)18-12-4-1-2-5-12/h7-10,12H,1-6,11H2,(H,18,22)(H,19,23)
InChIKeyMQRZQRWANWBWPR-UHFFFAOYSA-N
XLogP1.81
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.37
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

N-cyclohexyl-N'-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]oxamide
CID 30679262
N-cycloheptyl-N'-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]oxamide
CID 18584403
N-cyclopentyl-N'-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]oxamide
CID 30679550
N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide
CID 7686385
N-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 7686436
1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-3-[4-(2-oxopyrrolidin-1-yl)phenyl]urea
CID 128930624
N-cyclopentyl-N'-[4-(4-methylpiperazin-1-yl)phenyl]oxamide
CID 108505990
N'-(3-fluorophenyl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide
CID 30679220
1-[4-(azepan-4-ylamino)phenyl]pyrrolidin-2-one
CID 103981052
2-chloro-N-cyclohexyl-5-[[4-(2-oxopyrrolidin-1-yl)benzoyl]amino]benzamide
CID 60540482
N-cyclopentyl-N'-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]oxamide
CID 7627719
2-N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclobutane-1,2-dicarboxamide
CID 167890277

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N'-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide?
The IUPAC name of N-cyclopentyl-N'-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide (CID 30679166) is N-cyclopentyl-N'-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide.
What is the SMILES notation for N-cyclopentyl-N'-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide?
The canonical SMILES for N-cyclopentyl-N'-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide is O=C(Nc1ccc(N2CCCC2=O)cc1)C(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-N'-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide?
The InChIKey is MQRZQRWANWBWPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O3/c21-15-6-3-11-20(15)14-9-7-13(8-10-14)19-17(23)16(22)18-12-4-1-2-5-12/h7-10,12H,1-6,11H2,(H,18,22)(H,19,23).
What are the key properties of N-cyclopentyl-N'-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide?
N-cyclopentyl-N'-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide has a molecular weight of 315.37 g/mol, XLogP of 1.81, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N'-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide is sourced from PubChem (CID 30679166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).