3-(2-oxo-1H-imidazol-3-yl)propanamide

C6H9N3O2 — CID 103125236

IUPAC3-(2-oxo-1H-imidazol-3-yl)propanamide
SMILESNC(=O)CCn1cc[nH]c1=O
InChIInChI=1S/C6H9N3O2/c7-5(10)1-3-9-4-2-8-6(9)11/h2,4H,1,3H2,(H2,7,10)(H,8,11)
InChIKeyYQBPQRSDYMWAEN-UHFFFAOYSA-N
MW155.16 g/mol
LogP-0.95
Rot. Bonds3

About 3-(2-oxo-1H-imidazol-3-yl)propanamide

3-(2-oxo-1H-imidazol-3-yl)propanamide (PubChem CID 103125236) has the molecular formula C6H9N3O2 and a molecular weight of 155.16 g/mol. Its IUPAC name is 3-(2-oxo-1H-imidazol-3-yl)propanamide.

Molecular Properties

Compound Name3-(2-oxo-1H-imidazol-3-yl)propanamide
PubChem CID103125236
Molecular FormulaC6H9N3O2
Molecular Weight155.16 g/mol
Exact Mass155.07
IUPAC Name3-(2-oxo-1H-imidazol-3-yl)propanamide
SMILESNC(=O)CCn1cc[nH]c1=O
InChIInChI=1S/C6H9N3O2/c7-5(10)1-3-9-4-2-8-6(9)11/h2,4H,1,3H2,(H2,7,10)(H,8,11)
InChIKeyYQBPQRSDYMWAEN-UHFFFAOYSA-N
XLogP-0.95
TPSA80.88 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.16
LogP ≤ 5-0.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-(2-oxo-1H-imidazol-3-yl)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 3-(2-oxo-1H-imidazol-3-yl)propanamide?
The IUPAC name of 3-(2-oxo-1H-imidazol-3-yl)propanamide (CID 103125236) is 3-(2-oxo-1H-imidazol-3-yl)propanamide.
What is the SMILES notation for 3-(2-oxo-1H-imidazol-3-yl)propanamide?
The canonical SMILES for 3-(2-oxo-1H-imidazol-3-yl)propanamide is NC(=O)CCn1cc[nH]c1=O.
What is the InChIKey of 3-(2-oxo-1H-imidazol-3-yl)propanamide?
The InChIKey is YQBPQRSDYMWAEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O2/c7-5(10)1-3-9-4-2-8-6(9)11/h2,4H,1,3H2,(H2,7,10)(H,8,11).
What are the key properties of 3-(2-oxo-1H-imidazol-3-yl)propanamide?
3-(2-oxo-1H-imidazol-3-yl)propanamide has a molecular weight of 155.16 g/mol, XLogP of -0.95, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-oxo-1H-imidazol-3-yl)propanamide is sourced from PubChem (CID 103125236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).