2-phenyl-N-[(2-phenylphenyl)methyl]aniline

C25H21N — CID 163203960

IUPAC2-phenyl-N-[(2-phenylphenyl)methyl]aniline
SMILESc1ccc(-c2ccccc2CNc2ccccc2-c2ccccc2)cc1
InChIInChI=1S/C25H21N/c1-3-11-20(12-4-1)23-16-8-7-15-22(23)19-26-25-18-10-9-17-24(25)21-13-5-2-6-14-21/h1-18,26H,19H2
InChIKeyKANADOJRQFPXPW-UHFFFAOYSA-N
MW335.45 g/mol
LogP6.63
Rot. Bonds5

About 2-phenyl-N-[(2-phenylphenyl)methyl]aniline

2-phenyl-N-[(2-phenylphenyl)methyl]aniline (PubChem CID 163203960) has the molecular formula C25H21N and a molecular weight of 335.45 g/mol. Its IUPAC name is 2-phenyl-N-[(2-phenylphenyl)methyl]aniline.

Molecular Properties

Compound Name2-phenyl-N-[(2-phenylphenyl)methyl]aniline
PubChem CID163203960
Molecular FormulaC25H21N
Molecular Weight335.45 g/mol
Exact Mass335.17
IUPAC Name2-phenyl-N-[(2-phenylphenyl)methyl]aniline
SMILESc1ccc(-c2ccccc2CNc2ccccc2-c2ccccc2)cc1
InChIInChI=1S/C25H21N/c1-3-11-20(12-4-1)23-16-8-7-15-22(23)19-26-25-18-10-9-17-24(25)21-13-5-2-6-14-21/h1-18,26H,19H2
InChIKeyKANADOJRQFPXPW-UHFFFAOYSA-N
XLogP6.63
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500335.45
LogP ≤ 56.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-[(2-phenylphenyl)methyl]aniline?
The IUPAC name of 2-phenyl-N-[(2-phenylphenyl)methyl]aniline (CID 163203960) is 2-phenyl-N-[(2-phenylphenyl)methyl]aniline.
What is the SMILES notation for 2-phenyl-N-[(2-phenylphenyl)methyl]aniline?
The canonical SMILES for 2-phenyl-N-[(2-phenylphenyl)methyl]aniline is c1ccc(-c2ccccc2CNc2ccccc2-c2ccccc2)cc1.
What is the InChIKey of 2-phenyl-N-[(2-phenylphenyl)methyl]aniline?
The InChIKey is KANADOJRQFPXPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21N/c1-3-11-20(12-4-1)23-16-8-7-15-22(23)19-26-25-18-10-9-17-24(25)21-13-5-2-6-14-21/h1-18,26H,19H2.
What are the key properties of 2-phenyl-N-[(2-phenylphenyl)methyl]aniline?
2-phenyl-N-[(2-phenylphenyl)methyl]aniline has a molecular weight of 335.45 g/mol, XLogP of 6.63, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-[(2-phenylphenyl)methyl]aniline is sourced from PubChem (CID 163203960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).