4-oxoazetidine-1,2-dicarboxamide

C5H7N3O3 — CID 135154151

IUPAC4-oxoazetidine-1,2-dicarboxamide
SMILESNC(=O)C1CC(=O)N1C(N)=O
InChIInChI=1S/C5H7N3O3/c6-4(10)2-1-3(9)8(2)5(7)11/h2H,1H2,(H2,6,10)(H2,7,11)
InChIKeyMQAXKONRRSCXAL-UHFFFAOYSA-N
MW157.13 g/mol
LogP-1.85
Rot. Bonds1

About 4-oxoazetidine-1,2-dicarboxamide

4-oxoazetidine-1,2-dicarboxamide (PubChem CID 135154151) has the molecular formula C5H7N3O3 and a molecular weight of 157.13 g/mol. Its IUPAC name is 4-oxoazetidine-1,2-dicarboxamide.

Molecular Properties

Compound Name4-oxoazetidine-1,2-dicarboxamide
PubChem CID135154151
Molecular FormulaC5H7N3O3
Molecular Weight157.13 g/mol
Exact Mass157.05
IUPAC Name4-oxoazetidine-1,2-dicarboxamide
SMILESNC(=O)C1CC(=O)N1C(N)=O
InChIInChI=1S/C5H7N3O3/c6-4(10)2-1-3(9)8(2)5(7)11/h2H,1H2,(H2,6,10)(H2,7,11)
InChIKeyMQAXKONRRSCXAL-UHFFFAOYSA-N
XLogP-1.85
TPSA106.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.13
LogP ≤ 5-1.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-oxoazetidine-1,2-dicarboxamide 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

(3S)-3-carbamoyl-2-azabicyclo[3.1.0]hex-1(5)-ene-2-carboxylic acid
CID 90450054
6-methyl-5-oxothiomorpholine-3,4-dicarboxamide
CID 131727665
1-tert-butyl-5-oxopyrrolidine-2-carboxamide
CID 76802841
1-(2-amino-2-oxoethyl)-5-oxopyrrolidine-2-carboxamide
CID 3657675
1-methyl-5-oxopyrrolidine-3-carboxamide
CID 541476
(3S)-1-cyclopentyl-5-oxopyrrolidine-3-carboxamide
CID 29451208
3-methyl-2-oxo-1,3-thiazolidine-4-carboxamide
CID 141184233
5-oxo-1-(2-sulfanylethyl)pyrrolidine-3-carboxamide
CID 168697255
4-oxo-1-phenylmethoxycarbonylazetidine-2-carboxylic acid
CID 71382493
(2S)-5-oxo-1-phenylpyrrolidine-2-carboxamide
CID 134861017
3-oxo-2-azabicyclo[2.2.1]hept-5-ene-2-carboxamide
CID 15699124
(2R)-7-oxo-1,6-diazabicyclo[3.2.1]octane-2-carboxamide
CID 134172897

Frequently Asked Questions

What is the IUPAC name of 4-oxoazetidine-1,2-dicarboxamide?
The IUPAC name of 4-oxoazetidine-1,2-dicarboxamide (CID 135154151) is 4-oxoazetidine-1,2-dicarboxamide.
What is the SMILES notation for 4-oxoazetidine-1,2-dicarboxamide?
The canonical SMILES for 4-oxoazetidine-1,2-dicarboxamide is NC(=O)C1CC(=O)N1C(N)=O.
What is the InChIKey of 4-oxoazetidine-1,2-dicarboxamide?
The InChIKey is MQAXKONRRSCXAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3O3/c6-4(10)2-1-3(9)8(2)5(7)11/h2H,1H2,(H2,6,10)(H2,7,11).
What are the key properties of 4-oxoazetidine-1,2-dicarboxamide?
4-oxoazetidine-1,2-dicarboxamide has a molecular weight of 157.13 g/mol, XLogP of -1.85, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-oxoazetidine-1,2-dicarboxamide is sourced from PubChem (CID 135154151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).