2-(aminomethylideneamino)-N-methylpropanamide

C5H11N3O — CID 90245884

IUPAC2-(aminomethylideneamino)-N-methylpropanamide
SMILESCNC(=O)C(C)/N=C/N
InChIInChI=1S/C5H11N3O/c1-4(8-3-6)5(9)7-2/h3-4H,1-2H3,(H2,6,8)(H,7,9)
InChIKeyFMJFMPJOVCXGNZ-UHFFFAOYSA-N
MW129.16 g/mol
LogP-0.89
Rot. Bonds2

About 2-(aminomethylideneamino)-N-methylpropanamide

2-(aminomethylideneamino)-N-methylpropanamide (PubChem CID 90245884) has the molecular formula C5H11N3O and a molecular weight of 129.16 g/mol. Its IUPAC name is 2-(aminomethylideneamino)-N-methylpropanamide.

Molecular Properties

Compound Name2-(aminomethylideneamino)-N-methylpropanamide
PubChem CID90245884
Molecular FormulaC5H11N3O
Molecular Weight129.16 g/mol
Exact Mass129.09
IUPAC Name2-(aminomethylideneamino)-N-methylpropanamide
SMILESCNC(=O)C(C)/N=C/N
InChIInChI=1S/C5H11N3O/c1-4(8-3-6)5(9)7-2/h3-4H,1-2H3,(H2,6,8)(H,7,9)
InChIKeyFMJFMPJOVCXGNZ-UHFFFAOYSA-N
XLogP-0.89
TPSA67.48 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.16
LogP ≤ 5-0.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze 2-(aminomethylideneamino)-N-methylpropanamide 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 2-(aminomethylideneamino)-N-methylpropanamide?
The IUPAC name of 2-(aminomethylideneamino)-N-methylpropanamide (CID 90245884) is 2-(aminomethylideneamino)-N-methylpropanamide.
What is the SMILES notation for 2-(aminomethylideneamino)-N-methylpropanamide?
The canonical SMILES for 2-(aminomethylideneamino)-N-methylpropanamide is CNC(=O)C(C)/N=C/N.
What is the InChIKey of 2-(aminomethylideneamino)-N-methylpropanamide?
The InChIKey is FMJFMPJOVCXGNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N3O/c1-4(8-3-6)5(9)7-2/h3-4H,1-2H3,(H2,6,8)(H,7,9).
What are the key properties of 2-(aminomethylideneamino)-N-methylpropanamide?
2-(aminomethylideneamino)-N-methylpropanamide has a molecular weight of 129.16 g/mol, XLogP of -0.89, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethylideneamino)-N-methylpropanamide is sourced from PubChem (CID 90245884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).