N'-(4-hydroxyphenyl)benzenecarboximidamide;hydroiodide

C13H13IN2O — CID 3049208

IUPACN'-(4-hydroxyphenyl)benzenecarboximidamide;hydroiodide
SMILESI.N/C(=N\c1ccc(O)cc1)c1ccccc1
InChIInChI=1S/C13H12N2O.HI/c14-13(10-4-2-1-3-5-10)15-11-6-8-12(16)9-7-11;/h1-9,16H,(H2,14,15);1H
InChIKeyXSAVGQOJOWHEDI-UHFFFAOYSA-N
MW340.16 g/mol
LogP3.05
Rot. Bonds2

About N'-(4-hydroxyphenyl)benzenecarboximidamide;hydroiodide

N'-(4-hydroxyphenyl)benzenecarboximidamide;hydroiodide (PubChem CID 3049208) has the molecular formula C13H13IN2O and a molecular weight of 340.16 g/mol. Its IUPAC name is N'-(4-hydroxyphenyl)benzenecarboximidamide;hydroiodide.

Molecular Properties

Compound NameN'-(4-hydroxyphenyl)benzenecarboximidamide;hydroiodide
PubChem CID3049208
Molecular FormulaC13H13IN2O
Molecular Weight340.16 g/mol
Exact Mass340.01
IUPAC NameN'-(4-hydroxyphenyl)benzenecarboximidamide;hydroiodide
SMILESI.N/C(=N\c1ccc(O)cc1)c1ccccc1
InChIInChI=1S/C13H12N2O.HI/c14-13(10-4-2-1-3-5-10)15-11-6-8-12(16)9-7-11;/h1-9,16H,(H2,14,15);1H
InChIKeyXSAVGQOJOWHEDI-UHFFFAOYSA-N
XLogP3.05
TPSA58.61 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.16
LogP ≤ 53.05
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'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze N'-(4-hydroxyphenyl)benzenecarboximidamide;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 N'-(4-hydroxyphenyl)benzenecarboximidamide;hydroiodide?
The IUPAC name of N'-(4-hydroxyphenyl)benzenecarboximidamide;hydroiodide (CID 3049208) is N'-(4-hydroxyphenyl)benzenecarboximidamide;hydroiodide.
What is the SMILES notation for N'-(4-hydroxyphenyl)benzenecarboximidamide;hydroiodide?
The canonical SMILES for N'-(4-hydroxyphenyl)benzenecarboximidamide;hydroiodide is I.N/C(=N\c1ccc(O)cc1)c1ccccc1.
What is the InChIKey of N'-(4-hydroxyphenyl)benzenecarboximidamide;hydroiodide?
The InChIKey is XSAVGQOJOWHEDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O.HI/c14-13(10-4-2-1-3-5-10)15-11-6-8-12(16)9-7-11;/h1-9,16H,(H2,14,15);1H.
What are the key properties of N'-(4-hydroxyphenyl)benzenecarboximidamide;hydroiodide?
N'-(4-hydroxyphenyl)benzenecarboximidamide;hydroiodide has a molecular weight of 340.16 g/mol, XLogP of 3.05, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-hydroxyphenyl)benzenecarboximidamide;hydroiodide is sourced from PubChem (CID 3049208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).