2-[[amino(cyclopropyl)methylidene]amino]propanamide

C7H13N3O — CID 63176033

IUPAC2-[[amino(cyclopropyl)methylidene]amino]propanamide
SMILESCC(/N=C(\N)C1CC1)C(N)=O
InChIInChI=1S/C7H13N3O/c1-4(7(9)11)10-6(8)5-2-3-5/h4-5H,2-3H2,1H3,(H2,8,10)(H2,9,11)
InChIKeyQDMZAMKPAIGXEU-UHFFFAOYSA-N
MW155.20 g/mol
LogP-0.37
Rot. Bonds3

About 2-[[amino(cyclopropyl)methylidene]amino]propanamide

2-[[amino(cyclopropyl)methylidene]amino]propanamide (PubChem CID 63176033) has the molecular formula C7H13N3O and a molecular weight of 155.20 g/mol. Its IUPAC name is 2-[[amino(cyclopropyl)methylidene]amino]propanamide.

Molecular Properties

Compound Name2-[[amino(cyclopropyl)methylidene]amino]propanamide
PubChem CID63176033
Molecular FormulaC7H13N3O
Molecular Weight155.20 g/mol
Exact Mass155.11
IUPAC Name2-[[amino(cyclopropyl)methylidene]amino]propanamide
SMILESCC(/N=C(\N)C1CC1)C(N)=O
InChIInChI=1S/C7H13N3O/c1-4(7(9)11)10-6(8)5-2-3-5/h4-5H,2-3H2,1H3,(H2,8,10)(H2,9,11)
InChIKeyQDMZAMKPAIGXEU-UHFFFAOYSA-N
XLogP-0.37
TPSA81.47 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 5-0.37
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-[[amino(cyclopropyl)methylidene]amino]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 2-[[amino(cyclopropyl)methylidene]amino]propanamide?
The IUPAC name of 2-[[amino(cyclopropyl)methylidene]amino]propanamide (CID 63176033) is 2-[[amino(cyclopropyl)methylidene]amino]propanamide.
What is the SMILES notation for 2-[[amino(cyclopropyl)methylidene]amino]propanamide?
The canonical SMILES for 2-[[amino(cyclopropyl)methylidene]amino]propanamide is CC(/N=C(\N)C1CC1)C(N)=O.
What is the InChIKey of 2-[[amino(cyclopropyl)methylidene]amino]propanamide?
The InChIKey is QDMZAMKPAIGXEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O/c1-4(7(9)11)10-6(8)5-2-3-5/h4-5H,2-3H2,1H3,(H2,8,10)(H2,9,11).
What are the key properties of 2-[[amino(cyclopropyl)methylidene]amino]propanamide?
2-[[amino(cyclopropyl)methylidene]amino]propanamide has a molecular weight of 155.20 g/mol, XLogP of -0.37, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[amino(cyclopropyl)methylidene]amino]propanamide is sourced from PubChem (CID 63176033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).