N'-[(E)-2-phenylethenyl]benzenecarboximidamide

C15H14N2 — CID 13000093

IUPACN'-[(E)-2-phenylethenyl]benzenecarboximidamide
SMILESN/C(=N\C=C\c1ccccc1)c1ccccc1
InChIInChI=1S/C15H14N2/c16-15(14-9-5-2-6-10-14)17-12-11-13-7-3-1-4-8-13/h1-12H,(H2,16,17)/b12-11+
InChIKeyFEYQKOFEKAZCAW-VAWYXSNFSA-N
MW222.29 g/mol
LogP3.06
Rot. Bonds3

About N'-[(E)-2-phenylethenyl]benzenecarboximidamide

N'-[(E)-2-phenylethenyl]benzenecarboximidamide (PubChem CID 13000093) has the molecular formula C15H14N2 and a molecular weight of 222.29 g/mol. Its IUPAC name is N'-[(E)-2-phenylethenyl]benzenecarboximidamide.

Molecular Properties

Compound NameN'-[(E)-2-phenylethenyl]benzenecarboximidamide
PubChem CID13000093
Molecular FormulaC15H14N2
Molecular Weight222.29 g/mol
Exact Mass222.12
IUPAC NameN'-[(E)-2-phenylethenyl]benzenecarboximidamide
SMILESN/C(=N\C=C\c1ccccc1)c1ccccc1
InChIInChI=1S/C15H14N2/c16-15(14-9-5-2-6-10-14)17-12-11-13-7-3-1-4-8-13/h1-12H,(H2,16,17)/b12-11+
InChIKeyFEYQKOFEKAZCAW-VAWYXSNFSA-N
XLogP3.06
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 53.06
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'}

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Frequently Asked Questions

What is the IUPAC name of N'-[(E)-2-phenylethenyl]benzenecarboximidamide?
The IUPAC name of N'-[(E)-2-phenylethenyl]benzenecarboximidamide (CID 13000093) is N'-[(E)-2-phenylethenyl]benzenecarboximidamide.
What is the SMILES notation for N'-[(E)-2-phenylethenyl]benzenecarboximidamide?
The canonical SMILES for N'-[(E)-2-phenylethenyl]benzenecarboximidamide is N/C(=N\C=C\c1ccccc1)c1ccccc1.
What is the InChIKey of N'-[(E)-2-phenylethenyl]benzenecarboximidamide?
The InChIKey is FEYQKOFEKAZCAW-VAWYXSNFSA-N. The full InChI is InChI=1S/C15H14N2/c16-15(14-9-5-2-6-10-14)17-12-11-13-7-3-1-4-8-13/h1-12H,(H2,16,17)/b12-11+.
What are the key properties of N'-[(E)-2-phenylethenyl]benzenecarboximidamide?
N'-[(E)-2-phenylethenyl]benzenecarboximidamide has a molecular weight of 222.29 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(E)-2-phenylethenyl]benzenecarboximidamide is sourced from PubChem (CID 13000093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).