1-amino-2-methylguanidine;hydroiodide

C2H9IN4 — CID 2780866

IUPAC1-amino-2-methylguanidine;hydroiodide
SMILESC/N=C(\N)NN.I
InChIInChI=1S/C2H8N4.HI/c1-5-2(3)6-4;/h4H2,1H3,(H3,3,5,6);1H
InChIKeyAPGVZAAHWBJTFZ-UHFFFAOYSA-N
MW216.03 g/mol
LogP-0.99
Rot. Bonds

About 1-amino-2-methylguanidine;hydroiodide

1-amino-2-methylguanidine;hydroiodide (PubChem CID 2780866) has the molecular formula C2H9IN4 and a molecular weight of 216.03 g/mol. Its IUPAC name is 1-amino-2-methylguanidine;hydroiodide.

Molecular Properties

Compound Name1-amino-2-methylguanidine;hydroiodide
PubChem CID2780866
Molecular FormulaC2H9IN4
Molecular Weight216.03 g/mol
Exact Mass215.99
IUPAC Name1-amino-2-methylguanidine;hydroiodide
SMILESC/N=C(\N)NN.I
InChIInChI=1S/C2H8N4.HI/c1-5-2(3)6-4;/h4H2,1H3,(H3,3,5,6);1H
InChIKeyAPGVZAAHWBJTFZ-UHFFFAOYSA-N
XLogP-0.99
TPSA76.43 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.03
LogP ≤ 5-0.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-amino-2-methylguanidine;hydroiodide?
The IUPAC name of 1-amino-2-methylguanidine;hydroiodide (CID 2780866) is 1-amino-2-methylguanidine;hydroiodide.
What is the SMILES notation for 1-amino-2-methylguanidine;hydroiodide?
The canonical SMILES for 1-amino-2-methylguanidine;hydroiodide is C/N=C(\N)NN.I.
What is the InChIKey of 1-amino-2-methylguanidine;hydroiodide?
The InChIKey is APGVZAAHWBJTFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H8N4.HI/c1-5-2(3)6-4;/h4H2,1H3,(H3,3,5,6);1H.
What are the key properties of 1-amino-2-methylguanidine;hydroiodide?
1-amino-2-methylguanidine;hydroiodide has a molecular weight of 216.03 g/mol, XLogP of -0.99, 0 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-methylguanidine;hydroiodide is sourced from PubChem (CID 2780866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).