2-(3-methylphenyl)-6-phenylaniline

C19H17N — CID 150906011

IUPAC2-(3-methylphenyl)-6-phenylaniline
SMILESCc1cccc(-c2cccc(-c3ccccc3)c2N)c1
InChIInChI=1S/C19H17N/c1-14-7-5-10-16(13-14)18-12-6-11-17(19(18)20)15-8-3-2-4-9-15/h2-13H,20H2,1H3
InChIKeyLAZKSBVKKPVFAC-UHFFFAOYSA-N
MW259.35 g/mol
LogP4.91
Rot. Bonds2

About 2-(3-methylphenyl)-6-phenylaniline

2-(3-methylphenyl)-6-phenylaniline (PubChem CID 150906011) has the molecular formula C19H17N and a molecular weight of 259.35 g/mol. Its IUPAC name is 2-(3-methylphenyl)-6-phenylaniline.

Molecular Properties

Compound Name2-(3-methylphenyl)-6-phenylaniline
PubChem CID150906011
Molecular FormulaC19H17N
Molecular Weight259.35 g/mol
Exact Mass259.14
IUPAC Name2-(3-methylphenyl)-6-phenylaniline
SMILESCc1cccc(-c2cccc(-c3ccccc3)c2N)c1
InChIInChI=1S/C19H17N/c1-14-7-5-10-16(13-14)18-12-6-11-17(19(18)20)15-8-3-2-4-9-15/h2-13H,20H2,1H3
InChIKeyLAZKSBVKKPVFAC-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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Related Compounds

1,2-bis[3-(3-methylphenyl)phenyl]-4,5-diphenylbenzene
CID 59552772
methanamine;1-methyl-3-phenylbenzene
CID 145414985
1,1'-biphenyl;1-methyl-2-phenylbenzene;1-methyl-3-phenylbenzene
CID 159346959
2-(3-methylphenyl)phenol
CID 11206198
methane;1-(3-methylphenyl)-2,3,4,5-tetraphenylbenzene
CID 142335654
4-methyl-2-(3-methylphenyl)-1-[2-(3-methylphenyl)phenyl]benzene
CID 58892355
4-(3-methylphenyl)-1,2-diphenylbenzene
CID 59171658
1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene
CID 58879503
ethane;1-methyl-3-phenylbenzene
CID 142040878
2-bromo-1,3-bis(3-methylphenyl)benzene
CID 3691341
2-iodo-1,3-bis(3-methylphenyl)benzene
CID 170072024
methyl 2-amino-3-(3-methylphenyl)benzoate
CID 171919919

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylphenyl)-6-phenylaniline?
The IUPAC name of 2-(3-methylphenyl)-6-phenylaniline (CID 150906011) is 2-(3-methylphenyl)-6-phenylaniline.
What is the SMILES notation for 2-(3-methylphenyl)-6-phenylaniline?
The canonical SMILES for 2-(3-methylphenyl)-6-phenylaniline is Cc1cccc(-c2cccc(-c3ccccc3)c2N)c1.
What is the InChIKey of 2-(3-methylphenyl)-6-phenylaniline?
The InChIKey is LAZKSBVKKPVFAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N/c1-14-7-5-10-16(13-14)18-12-6-11-17(19(18)20)15-8-3-2-4-9-15/h2-13H,20H2,1H3.
What are the key properties of 2-(3-methylphenyl)-6-phenylaniline?
2-(3-methylphenyl)-6-phenylaniline 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 2-(3-methylphenyl)-6-phenylaniline is sourced from PubChem (CID 150906011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).