methanamine;propanimidamide

C4H13N3 — CID 158653796

IUPACmethanamine;propanimidamide
SMILESCN.[H]/N=C(/N)CC
InChIInChI=1S/C3H8N2.CH5N/c1-2-3(4)5;1-2/h2H2,1H3,(H3,4,5);2H2,1H3
InChIKeyIBWLQRHONHGCHA-UHFFFAOYSA-N
MW103.17 g/mol
LogP-0.09
Rot. Bonds1

About methanamine;propanimidamide

methanamine;propanimidamide (PubChem CID 158653796) has the molecular formula C4H13N3 and a molecular weight of 103.17 g/mol. Its IUPAC name is methanamine;propanimidamide.

Molecular Properties

Compound Namemethanamine;propanimidamide
PubChem CID158653796
Molecular FormulaC4H13N3
Molecular Weight103.17 g/mol
Exact Mass103.11
IUPAC Namemethanamine;propanimidamide
SMILESCN.[H]/N=C(/N)CC
InChIInChI=1S/C3H8N2.CH5N/c1-2-3(4)5;1-2/h2H2,1H3,(H3,4,5);2H2,1H3
InChIKeyIBWLQRHONHGCHA-UHFFFAOYSA-N
XLogP-0.09
TPSA75.89 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.17
LogP ≤ 5-0.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze methanamine;propanimidamide 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

N,N-dimethylformamide;propanimidamide;hydrochloride
CID 160949006
3-ethyl-1H-diazirine;propanimidamide
CID 70146643
2-(diethylamino)ethanimidamide
CID 3259588
butanediimidamide;dihydrochloride
CID 88614640
3-aminopentanimidamide
CID 79498775
3,3-dimethylpentanimidamide
CID 143852349
2-(2,4,6-trimethylphenyl)ethanimidamide
CID 3660165
2-[hydroxy(methyl)amino]ethanimidamide
CID 87382268
2-(2,3,4,5,6-pentafluorophenyl)ethanimidamide;hydrochloride
CID 19691433
2-[4-(2-amino-2-iminoethyl)phenyl]ethanimidamide
CID 3685928
3-methylbutanimidamide;hydrochloride
CID 18967932
3-(diethylamino)propanimidamide;hydrochloride
CID 82021474

Frequently Asked Questions

What is the IUPAC name of methanamine;propanimidamide?
The IUPAC name of methanamine;propanimidamide (CID 158653796) is methanamine;propanimidamide.
What is the SMILES notation for methanamine;propanimidamide?
The canonical SMILES for methanamine;propanimidamide is CN.[H]/N=C(/N)CC.
What is the InChIKey of methanamine;propanimidamide?
The InChIKey is IBWLQRHONHGCHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8N2.CH5N/c1-2-3(4)5;1-2/h2H2,1H3,(H3,4,5);2H2,1H3.
What are the key properties of methanamine;propanimidamide?
methanamine;propanimidamide has a molecular weight of 103.17 g/mol, XLogP of -0.09, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methanamine;propanimidamide is sourced from PubChem (CID 158653796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).