N'-phenylbenzenecarboximidamide;hydroiodide

C13H13IN2 — CID 3049207

IUPACN'-phenylbenzenecarboximidamide;hydroiodide
SMILESI.N/C(=N\c1ccccc1)c1ccccc1
InChIInChI=1S/C13H12N2.HI/c14-13(11-7-3-1-4-8-11)15-12-9-5-2-6-10-12;/h1-10H,(H2,14,15);1H
InChIKeyVKJPYCILSNITIZ-UHFFFAOYSA-N
MW324.17 g/mol
LogP3.34
Rot. Bonds2

About N'-phenylbenzenecarboximidamide;hydroiodide

N'-phenylbenzenecarboximidamide;hydroiodide (PubChem CID 3049207) has the molecular formula C13H13IN2 and a molecular weight of 324.17 g/mol. Its IUPAC name is N'-phenylbenzenecarboximidamide;hydroiodide.

Molecular Properties

Compound NameN'-phenylbenzenecarboximidamide;hydroiodide
PubChem CID3049207
Molecular FormulaC13H13IN2
Molecular Weight324.17 g/mol
Exact Mass324.01
IUPAC NameN'-phenylbenzenecarboximidamide;hydroiodide
SMILESI.N/C(=N\c1ccccc1)c1ccccc1
InChIInChI=1S/C13H12N2.HI/c14-13(11-7-3-1-4-8-11)15-12-9-5-2-6-10-12;/h1-10H,(H2,14,15);1H
InChIKeyVKJPYCILSNITIZ-UHFFFAOYSA-N
XLogP3.34
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.17
LogP ≤ 53.34
H-Bond Donors ≤ 51
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'}

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Related Compounds

Diminazene
CID 2354
p-Aminobenzamidine
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o-Tolylbiguanide
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4-Amidinoaniline dihydrochloride
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Benzenecarboximidamide, 4-amino-, hydrochloride (1:1)
CID 122765
1-carbamimidamido-N-(4-methylphenyl)methanimidamide
CID 2730263
N-Phenylbenzamidine
CID 200127
N-Benzylideneaniline
CID 10858
Benzenecarboximidamide, N-(4-chlorophenyl)-
CID 2304945
Guanidine, 4,4'-methylenediphenyldi-
CID 24484
Benzenecarboximidamide, 3-amino-, hydrochloride (1:1)
CID 197789
N-Phenylbenzimidoyl cyanide
CID 231999

Frequently Asked Questions

What is the IUPAC name of N'-phenylbenzenecarboximidamide;hydroiodide?
The IUPAC name of N'-phenylbenzenecarboximidamide;hydroiodide (CID 3049207) is N'-phenylbenzenecarboximidamide;hydroiodide.
What is the SMILES notation for N'-phenylbenzenecarboximidamide;hydroiodide?
The canonical SMILES for N'-phenylbenzenecarboximidamide;hydroiodide is I.N/C(=N\c1ccccc1)c1ccccc1.
What is the InChIKey of N'-phenylbenzenecarboximidamide;hydroiodide?
The InChIKey is VKJPYCILSNITIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2.HI/c14-13(11-7-3-1-4-8-11)15-12-9-5-2-6-10-12;/h1-10H,(H2,14,15);1H.
What are the key properties of N'-phenylbenzenecarboximidamide;hydroiodide?
N'-phenylbenzenecarboximidamide;hydroiodide has a molecular weight of 324.17 g/mol, XLogP of 3.34, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-phenylbenzenecarboximidamide;hydroiodide is sourced from PubChem (CID 3049207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).