N'-(4-phenylphenyl)cyclopropanecarboximidamide

C16H16N2 — CID 55160926

IUPACN'-(4-phenylphenyl)cyclopropanecarboximidamide
SMILESN/C(=N\c1ccc(-c2ccccc2)cc1)C1CC1
InChIInChI=1S/C16H16N2/c17-16(14-6-7-14)18-15-10-8-13(9-11-15)12-4-2-1-3-5-12/h1-5,8-11,14H,6-7H2,(H2,17,18)
InChIKeySQJYTBKFADFGJE-UHFFFAOYSA-N
MW236.32 g/mol
LogP3.75
Rot. Bonds3

About N'-(4-phenylphenyl)cyclopropanecarboximidamide

N'-(4-phenylphenyl)cyclopropanecarboximidamide (PubChem CID 55160926) has the molecular formula C16H16N2 and a molecular weight of 236.32 g/mol. Its IUPAC name is N'-(4-phenylphenyl)cyclopropanecarboximidamide.

Molecular Properties

Compound NameN'-(4-phenylphenyl)cyclopropanecarboximidamide
PubChem CID55160926
Molecular FormulaC16H16N2
Molecular Weight236.32 g/mol
Exact Mass236.13
IUPAC NameN'-(4-phenylphenyl)cyclopropanecarboximidamide
SMILESN/C(=N\c1ccc(-c2ccccc2)cc1)C1CC1
InChIInChI=1S/C16H16N2/c17-16(14-6-7-14)18-15-10-8-13(9-11-15)12-4-2-1-3-5-12/h1-5,8-11,14H,6-7H2,(H2,17,18)
InChIKeySQJYTBKFADFGJE-UHFFFAOYSA-N
XLogP3.75
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 53.75
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'-(4-phenylphenyl)cyclopropanecarboximidamide?
The IUPAC name of N'-(4-phenylphenyl)cyclopropanecarboximidamide (CID 55160926) is N'-(4-phenylphenyl)cyclopropanecarboximidamide.
What is the SMILES notation for N'-(4-phenylphenyl)cyclopropanecarboximidamide?
The canonical SMILES for N'-(4-phenylphenyl)cyclopropanecarboximidamide is N/C(=N\c1ccc(-c2ccccc2)cc1)C1CC1.
What is the InChIKey of N'-(4-phenylphenyl)cyclopropanecarboximidamide?
The InChIKey is SQJYTBKFADFGJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2/c17-16(14-6-7-14)18-15-10-8-13(9-11-15)12-4-2-1-3-5-12/h1-5,8-11,14H,6-7H2,(H2,17,18).
What are the key properties of N'-(4-phenylphenyl)cyclopropanecarboximidamide?
N'-(4-phenylphenyl)cyclopropanecarboximidamide has a molecular weight of 236.32 g/mol, XLogP of 3.75, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-phenylphenyl)cyclopropanecarboximidamide is sourced from PubChem (CID 55160926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).