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

C10H18N2O2 — CID 19386851

IUPACN-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide
SMILESCCC(=O)NCCCN1CCCC1=O
InChIInChI=1S/C10H18N2O2/c1-2-9(13)11-6-4-8-12-7-3-5-10(12)14/h2-8H2,1H3,(H,11,13)
InChIKeyQVVOHYJKTAVJDX-UHFFFAOYSA-N
MW198.27 g/mol
LogP0.53
Rot. Bonds5

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

N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide (PubChem CID 19386851) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide.

Molecular Properties

Compound NameN-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide
PubChem CID19386851
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC NameN-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide
SMILESCCC(=O)NCCCN1CCCC1=O
InChIInChI=1S/C10H18N2O2/c1-2-9(13)11-6-4-8-12-7-3-5-10(12)14/h2-8H2,1H3,(H,11,13)
InChIKeyQVVOHYJKTAVJDX-UHFFFAOYSA-N
XLogP0.53
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide?
The IUPAC name of N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide (CID 19386851) is N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide.
What is the SMILES notation for N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide?
The canonical SMILES for N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide is CCC(=O)NCCCN1CCCC1=O.
What is the InChIKey of N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide?
The InChIKey is QVVOHYJKTAVJDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-2-9(13)11-6-4-8-12-7-3-5-10(12)14/h2-8H2,1H3,(H,11,13).
What are the key properties of N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide?
N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide has a molecular weight of 198.27 g/mol, XLogP of 0.53, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide is sourced from PubChem (CID 19386851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).