2-methyl-N-[4-(4-methylphenyl)phenyl]-N-phenylnaphthalen-1-amine

C30H25N — CID 166990192

IUPAC2-methyl-N-[4-(4-methylphenyl)phenyl]-N-phenylnaphthalen-1-amine
SMILESCc1ccc(-c2ccc(N(c3ccccc3)c3c(C)ccc4ccccc34)cc2)cc1
InChIInChI=1S/C30H25N/c1-22-12-15-24(16-13-22)25-18-20-28(21-19-25)31(27-9-4-3-5-10-27)30-23(2)14-17-26-8-6-7-11-29(26)30/h3-21H,1-2H3
InChIKeyONNPQLJIYJLXPH-UHFFFAOYSA-N
MW399.54 g/mol
LogP8.59
Rot. Bonds4

About 2-methyl-N-[4-(4-methylphenyl)phenyl]-N-phenylnaphthalen-1-amine

2-methyl-N-[4-(4-methylphenyl)phenyl]-N-phenylnaphthalen-1-amine (PubChem CID 166990192) has the molecular formula C30H25N and a molecular weight of 399.54 g/mol. Its IUPAC name is 2-methyl-N-[4-(4-methylphenyl)phenyl]-N-phenylnaphthalen-1-amine.

Molecular Properties

Compound Name2-methyl-N-[4-(4-methylphenyl)phenyl]-N-phenylnaphthalen-1-amine
PubChem CID166990192
Molecular FormulaC30H25N
Molecular Weight399.54 g/mol
Exact Mass399.20
IUPAC Name2-methyl-N-[4-(4-methylphenyl)phenyl]-N-phenylnaphthalen-1-amine
SMILESCc1ccc(-c2ccc(N(c3ccccc3)c3c(C)ccc4ccccc34)cc2)cc1
InChIInChI=1S/C30H25N/c1-22-12-15-24(16-13-22)25-18-20-28(21-19-25)31(27-9-4-3-5-10-27)30-23(2)14-17-26-8-6-7-11-29(26)30/h3-21H,1-2H3
InChIKeyONNPQLJIYJLXPH-UHFFFAOYSA-N
XLogP8.59
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500399.54
LogP ≤ 58.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-methyl-N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 144939242
5-N,5-N,11-N-tris(4-methylphenyl)-11-N-phenyltetracene-5,11-diamine
CID 59987799
N,N-diphenyl-4-[4-(N-phenylanilino)phenyl]aniline;4-methyl-N-[4-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]phenyl]-N-(4-methylphenyl)aniline;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 154945555
4-methyl-N-(4-phenanthren-3-ylphenyl)-N-(4-phenylphenyl)aniline
CID 118122906
1-methyl-N-[4-[4-(N-(1-methylnaphthalen-2-yl)anilino)phenyl]phenyl]-N-phenylnaphthalen-2-amine
CID 141305521
4-N,4-N-bis(4-methylphenyl)-1-N-phenyl-1-N-[4-[4-(N-phenylanilino)phenyl]phenyl]benzene-1,4-diamine
CID 171844865
4-N-[4-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine
CID 165386569
1-N-[4-[4-(N-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]anilino)phenyl]phenyl]-4-N,4-N-bis(4-methylphenyl)-1-N-phenylbenzene-1,4-diamine
CID 21351107
4-methyl-N-[4-[4-(N-[4-[4-(N-(4-methylphenyl)anilino)phenyl]phenyl]anilino)phenyl]phenyl]-N-phenylaniline
CID 22598588
2-methyl-N-[4-[4-(N-[(Z,1E)-2-methyl-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)but-2-enyl]anilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 142508119
5-N,5-N,11-N,11-N-tetrakis(4-methylphenyl)tetracene-5,11-diamine
CID 20730668
ethane;3-methylperylene;4-methyl-N-phenyl-N-(4-phenylphenyl)aniline
CID 143269201

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[4-(4-methylphenyl)phenyl]-N-phenylnaphthalen-1-amine?
The IUPAC name of 2-methyl-N-[4-(4-methylphenyl)phenyl]-N-phenylnaphthalen-1-amine (CID 166990192) is 2-methyl-N-[4-(4-methylphenyl)phenyl]-N-phenylnaphthalen-1-amine.
What is the SMILES notation for 2-methyl-N-[4-(4-methylphenyl)phenyl]-N-phenylnaphthalen-1-amine?
The canonical SMILES for 2-methyl-N-[4-(4-methylphenyl)phenyl]-N-phenylnaphthalen-1-amine is Cc1ccc(-c2ccc(N(c3ccccc3)c3c(C)ccc4ccccc34)cc2)cc1.
What is the InChIKey of 2-methyl-N-[4-(4-methylphenyl)phenyl]-N-phenylnaphthalen-1-amine?
The InChIKey is ONNPQLJIYJLXPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H25N/c1-22-12-15-24(16-13-22)25-18-20-28(21-19-25)31(27-9-4-3-5-10-27)30-23(2)14-17-26-8-6-7-11-29(26)30/h3-21H,1-2H3.
What are the key properties of 2-methyl-N-[4-(4-methylphenyl)phenyl]-N-phenylnaphthalen-1-amine?
2-methyl-N-[4-(4-methylphenyl)phenyl]-N-phenylnaphthalen-1-amine has a molecular weight of 399.54 g/mol, XLogP of 8.59, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[4-(4-methylphenyl)phenyl]-N-phenylnaphthalen-1-amine is sourced from PubChem (CID 166990192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).