3-[2-(2-methylphenyl)phenyl]aniline

C19H17N — CID 174293524

IUPAC3-[2-(2-methylphenyl)phenyl]aniline
SMILESCc1ccccc1-c1ccccc1-c1cccc(N)c1
InChIInChI=1S/C19H17N/c1-14-7-2-3-10-17(14)19-12-5-4-11-18(19)15-8-6-9-16(20)13-15/h2-13H,20H2,1H3
InChIKeyJNQFNJYSLYHWBC-UHFFFAOYSA-N
MW259.35 g/mol
LogP4.91
Rot. Bonds2

About 3-[2-(2-methylphenyl)phenyl]aniline

3-[2-(2-methylphenyl)phenyl]aniline (PubChem CID 174293524) has the molecular formula C19H17N and a molecular weight of 259.35 g/mol. Its IUPAC name is 3-[2-(2-methylphenyl)phenyl]aniline.

Molecular Properties

Compound Name3-[2-(2-methylphenyl)phenyl]aniline
PubChem CID174293524
Molecular FormulaC19H17N
Molecular Weight259.35 g/mol
Exact Mass259.14
IUPAC Name3-[2-(2-methylphenyl)phenyl]aniline
SMILESCc1ccccc1-c1ccccc1-c1cccc(N)c1
InChIInChI=1S/C19H17N/c1-14-7-2-3-10-17(14)19-12-5-4-11-18(19)15-8-6-9-16(20)13-15/h2-13H,20H2,1H3
InChIKeyJNQFNJYSLYHWBC-UHFFFAOYSA-N
XLogP4.91
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-methylphenyl)phenyl]aniline?
The IUPAC name of 3-[2-(2-methylphenyl)phenyl]aniline (CID 174293524) is 3-[2-(2-methylphenyl)phenyl]aniline.
What is the SMILES notation for 3-[2-(2-methylphenyl)phenyl]aniline?
The canonical SMILES for 3-[2-(2-methylphenyl)phenyl]aniline is Cc1ccccc1-c1ccccc1-c1cccc(N)c1.
What is the InChIKey of 3-[2-(2-methylphenyl)phenyl]aniline?
The InChIKey is JNQFNJYSLYHWBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N/c1-14-7-2-3-10-17(14)19-12-5-4-11-18(19)15-8-6-9-16(20)13-15/h2-13H,20H2,1H3.
What are the key properties of 3-[2-(2-methylphenyl)phenyl]aniline?
3-[2-(2-methylphenyl)phenyl]aniline has a molecular weight of 259.35 g/mol, XLogP of 4.91, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-methylphenyl)phenyl]aniline is sourced from PubChem (CID 174293524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).