N-[3-(2-oxopyrrolidin-1-yl)propyl]-N'-phenyloxamide

C15H19N3O3 — CID 7541598

IUPACN-[3-(2-oxopyrrolidin-1-yl)propyl]-N'-phenyloxamide
SMILESO=C(NCCCN1CCCC1=O)C(=O)Nc1ccccc1
InChIInChI=1S/C15H19N3O3/c19-13-8-4-10-18(13)11-5-9-16-14(20)15(21)17-12-6-2-1-3-7-12/h1-3,6-7H,4-5,8-11H2,(H,16,20)(H,17,21)
InChIKeyRMZPYBGVLUGFBY-UHFFFAOYSA-N
MW289.33 g/mol
LogP0.75
Rot. Bonds5

About N-[3-(2-oxopyrrolidin-1-yl)propyl]-N'-phenyloxamide

N-[3-(2-oxopyrrolidin-1-yl)propyl]-N'-phenyloxamide (PubChem CID 7541598) has the molecular formula C15H19N3O3 and a molecular weight of 289.33 g/mol. Its IUPAC name is N-[3-(2-oxopyrrolidin-1-yl)propyl]-N'-phenyloxamide.

Molecular Properties

Compound NameN-[3-(2-oxopyrrolidin-1-yl)propyl]-N'-phenyloxamide
PubChem CID7541598
Molecular FormulaC15H19N3O3
Molecular Weight289.33 g/mol
Exact Mass289.14
IUPAC NameN-[3-(2-oxopyrrolidin-1-yl)propyl]-N'-phenyloxamide
SMILESO=C(NCCCN1CCCC1=O)C(=O)Nc1ccccc1
InChIInChI=1S/C15H19N3O3/c19-13-8-4-10-18(13)11-5-9-16-14(20)15(21)17-12-6-2-1-3-7-12/h1-3,6-7H,4-5,8-11H2,(H,16,20)(H,17,21)
InChIKeyRMZPYBGVLUGFBY-UHFFFAOYSA-N
XLogP0.75
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(2-oxopyrrolidin-1-yl)propyl]-4-phenylbenzamide
CID 4787941
N'-tert-butyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]oxamide
CID 45000134
N'-(3-chloro-4-methoxyphenyl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]oxamide
CID 44902400
N-[3-(2-oxopyrrolidin-1-yl)propyl]-N'-(pyridin-4-ylmethyl)oxamide
CID 44998685
N'-[(4-chlorophenyl)methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]oxamide
CID 18588547
N-[3-(2-oxopyrrolidin-1-yl)propyl]-2-(4-phenylphenyl)acetamide
CID 27258939
N-[3-(2-oxopyrrolidin-1-yl)propyl]-N'-(2-phenyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)oxamide
CID 7673300
N'-(2-methoxyethyl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]oxamide
CID 45497345
2-(2-oxopyrrolidin-1-yl)ethyl N-phenylcarbamate
CID 117060433
2-(dibenzylamino)-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide
CID 86977003
3-methyl-N-[3-(2-oxoazepan-1-yl)propyl]-2-(phenylcarbamoylamino)butanamide
CID 55340431
3-acetamido-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzamide
CID 30482762

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-oxopyrrolidin-1-yl)propyl]-N'-phenyloxamide?
The IUPAC name of N-[3-(2-oxopyrrolidin-1-yl)propyl]-N'-phenyloxamide (CID 7541598) is N-[3-(2-oxopyrrolidin-1-yl)propyl]-N'-phenyloxamide.
What is the SMILES notation for N-[3-(2-oxopyrrolidin-1-yl)propyl]-N'-phenyloxamide?
The canonical SMILES for N-[3-(2-oxopyrrolidin-1-yl)propyl]-N'-phenyloxamide is O=C(NCCCN1CCCC1=O)C(=O)Nc1ccccc1.
What is the InChIKey of N-[3-(2-oxopyrrolidin-1-yl)propyl]-N'-phenyloxamide?
The InChIKey is RMZPYBGVLUGFBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c19-13-8-4-10-18(13)11-5-9-16-14(20)15(21)17-12-6-2-1-3-7-12/h1-3,6-7H,4-5,8-11H2,(H,16,20)(H,17,21).
What are the key properties of N-[3-(2-oxopyrrolidin-1-yl)propyl]-N'-phenyloxamide?
N-[3-(2-oxopyrrolidin-1-yl)propyl]-N'-phenyloxamide has a molecular weight of 289.33 g/mol, XLogP of 0.75, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-oxopyrrolidin-1-yl)propyl]-N'-phenyloxamide is sourced from PubChem (CID 7541598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).