3-(carbamoylamino)-2-methylprop-2-enamide

C5H9N3O2 — CID 87367732

IUPAC3-(carbamoylamino)-2-methylprop-2-enamide
SMILESCC(=CNC(N)=O)C(N)=O
InChIInChI=1S/C5H9N3O2/c1-3(4(6)9)2-8-5(7)10/h2H,1H3,(H2,6,9)(H3,7,8,10)
InChIKeyFZRJKYKFDBIQIZ-UHFFFAOYSA-N
MW143.15 g/mol
LogP-0.96
Rot. Bonds2

About 3-(carbamoylamino)-2-methylprop-2-enamide

3-(carbamoylamino)-2-methylprop-2-enamide (PubChem CID 87367732) has the molecular formula C5H9N3O2 and a molecular weight of 143.15 g/mol. Its IUPAC name is 3-(carbamoylamino)-2-methylprop-2-enamide.

Molecular Properties

Compound Name3-(carbamoylamino)-2-methylprop-2-enamide
PubChem CID87367732
Molecular FormulaC5H9N3O2
Molecular Weight143.15 g/mol
Exact Mass143.07
IUPAC Name3-(carbamoylamino)-2-methylprop-2-enamide
SMILESCC(=CNC(N)=O)C(N)=O
InChIInChI=1S/C5H9N3O2/c1-3(4(6)9)2-8-5(7)10/h2H,1H3,(H2,6,9)(H3,7,8,10)
InChIKeyFZRJKYKFDBIQIZ-UHFFFAOYSA-N
XLogP-0.96
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.15
LogP ≤ 5-0.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze 3-(carbamoylamino)-2-methylprop-2-enamide 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-(carbamoylamino)-2-methylprop-2-enamide?
The IUPAC name of 3-(carbamoylamino)-2-methylprop-2-enamide (CID 87367732) is 3-(carbamoylamino)-2-methylprop-2-enamide.
What is the SMILES notation for 3-(carbamoylamino)-2-methylprop-2-enamide?
The canonical SMILES for 3-(carbamoylamino)-2-methylprop-2-enamide is CC(=CNC(N)=O)C(N)=O.
What is the InChIKey of 3-(carbamoylamino)-2-methylprop-2-enamide?
The InChIKey is FZRJKYKFDBIQIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3O2/c1-3(4(6)9)2-8-5(7)10/h2H,1H3,(H2,6,9)(H3,7,8,10).
What are the key properties of 3-(carbamoylamino)-2-methylprop-2-enamide?
3-(carbamoylamino)-2-methylprop-2-enamide has a molecular weight of 143.15 g/mol, XLogP of -0.96, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(carbamoylamino)-2-methylprop-2-enamide is sourced from PubChem (CID 87367732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).