4-chlorobenzenecarboximidamide;hydroiodide

C7H8ClIN2 — CID 2734221

IUPAC4-chlorobenzenecarboximidamide;hydroiodide
SMILESI.[H]/N=C(\N)c1ccc(Cl)cc1
InChIInChI=1S/C7H7ClN2.HI/c8-6-3-1-5(2-4-6)7(9)10;/h1-4H,(H3,9,10);1H
InChIKeyYMEVGWRZEYGNJO-UHFFFAOYSA-N
MW282.51 g/mol
LogP2.24
Rot. Bonds1

About 4-chlorobenzenecarboximidamide;hydroiodide

4-chlorobenzenecarboximidamide;hydroiodide (PubChem CID 2734221) has the molecular formula C7H8ClIN2 and a molecular weight of 282.51 g/mol. Its IUPAC name is 4-chlorobenzenecarboximidamide;hydroiodide.

Molecular Properties

Compound Name4-chlorobenzenecarboximidamide;hydroiodide
PubChem CID2734221
Molecular FormulaC7H8ClIN2
Molecular Weight282.51 g/mol
Exact Mass281.94
IUPAC Name4-chlorobenzenecarboximidamide;hydroiodide
SMILESI.[H]/N=C(\N)c1ccc(Cl)cc1
InChIInChI=1S/C7H7ClN2.HI/c8-6-3-1-5(2-4-6)7(9)10;/h1-4H,(H3,9,10);1H
InChIKeyYMEVGWRZEYGNJO-UHFFFAOYSA-N
XLogP2.24
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.51
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 4-chlorobenzenecarboximidamide;hydroiodide 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 4-chlorobenzenecarboximidamide;hydroiodide?
The IUPAC name of 4-chlorobenzenecarboximidamide;hydroiodide (CID 2734221) is 4-chlorobenzenecarboximidamide;hydroiodide.
What is the SMILES notation for 4-chlorobenzenecarboximidamide;hydroiodide?
The canonical SMILES for 4-chlorobenzenecarboximidamide;hydroiodide is I.[H]/N=C(\N)c1ccc(Cl)cc1.
What is the InChIKey of 4-chlorobenzenecarboximidamide;hydroiodide?
The InChIKey is YMEVGWRZEYGNJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClN2.HI/c8-6-3-1-5(2-4-6)7(9)10;/h1-4H,(H3,9,10);1H.
What are the key properties of 4-chlorobenzenecarboximidamide;hydroiodide?
4-chlorobenzenecarboximidamide;hydroiodide has a molecular weight of 282.51 g/mol, XLogP of 2.24, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chlorobenzenecarboximidamide;hydroiodide is sourced from PubChem (CID 2734221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).