1-N-phenyl-2-N-(2-phenylphenyl)benzene-1,2-diamine

C24H20N2 — CID 118429255

IUPAC1-N-phenyl-2-N-(2-phenylphenyl)benzene-1,2-diamine
SMILESc1ccc(Nc2ccccc2Nc2ccccc2-c2ccccc2)cc1
InChIInChI=1S/C24H20N2/c1-3-11-19(12-4-1)21-15-7-8-16-22(21)26-24-18-10-9-17-23(24)25-20-13-5-2-6-14-20/h1-18,25-26H
InChIKeyQJQZNBNNIXAZDA-UHFFFAOYSA-N
MW336.44 g/mol
LogP6.84
Rot. Bonds5

About 1-N-phenyl-2-N-(2-phenylphenyl)benzene-1,2-diamine

1-N-phenyl-2-N-(2-phenylphenyl)benzene-1,2-diamine (PubChem CID 118429255) has the molecular formula C24H20N2 and a molecular weight of 336.44 g/mol. Its IUPAC name is 1-N-phenyl-2-N-(2-phenylphenyl)benzene-1,2-diamine.

Molecular Properties

Compound Name1-N-phenyl-2-N-(2-phenylphenyl)benzene-1,2-diamine
PubChem CID118429255
Molecular FormulaC24H20N2
Molecular Weight336.44 g/mol
Exact Mass336.16
IUPAC Name1-N-phenyl-2-N-(2-phenylphenyl)benzene-1,2-diamine
SMILESc1ccc(Nc2ccccc2Nc2ccccc2-c2ccccc2)cc1
InChIInChI=1S/C24H20N2/c1-3-11-19(12-4-1)21-15-7-8-16-22(21)26-24-18-10-9-17-23(24)25-20-13-5-2-6-14-20/h1-18,25-26H
InChIKeyQJQZNBNNIXAZDA-UHFFFAOYSA-N
XLogP6.84
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.44
LogP ≤ 56.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-N-phenyl-2-N-(2-phenylphenyl)benzene-1,2-diamine?
The IUPAC name of 1-N-phenyl-2-N-(2-phenylphenyl)benzene-1,2-diamine (CID 118429255) is 1-N-phenyl-2-N-(2-phenylphenyl)benzene-1,2-diamine.
What is the SMILES notation for 1-N-phenyl-2-N-(2-phenylphenyl)benzene-1,2-diamine?
The canonical SMILES for 1-N-phenyl-2-N-(2-phenylphenyl)benzene-1,2-diamine is c1ccc(Nc2ccccc2Nc2ccccc2-c2ccccc2)cc1.
What is the InChIKey of 1-N-phenyl-2-N-(2-phenylphenyl)benzene-1,2-diamine?
The InChIKey is QJQZNBNNIXAZDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N2/c1-3-11-19(12-4-1)21-15-7-8-16-22(21)26-24-18-10-9-17-23(24)25-20-13-5-2-6-14-20/h1-18,25-26H.
What are the key properties of 1-N-phenyl-2-N-(2-phenylphenyl)benzene-1,2-diamine?
1-N-phenyl-2-N-(2-phenylphenyl)benzene-1,2-diamine has a molecular weight of 336.44 g/mol, XLogP of 6.84, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-phenyl-2-N-(2-phenylphenyl)benzene-1,2-diamine is sourced from PubChem (CID 118429255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).