4-methyl-N,N-diphenylaniline;1-methyl-2-(4-methylphenyl)benzimidazole;9-(4-methylphenyl)carbazole;N-(4-methylphenyl)-N-naphthalen-2-ylnaphthalen-2-amine;N-(4-methylphenyl)-N-phenylnaphthalen-1-amine;N-(4-methylphenyl)-N-phenylnaphthalen-2-amine

C126H105N7 — CID 160621708

IUPAC4-methyl-N,N-diphenylaniline;1-methyl-2-(4-methylphenyl)benzimidazole;9-(4-methylphenyl)carbazole;N-(4-methylphenyl)-N-naphthalen-2-ylnaphthalen-2-amine;N-(4-methylphenyl)-N-phenylnaphthalen-1-amine;N-(4-methylphenyl)-N-phenylnaphthalen-2-amine
SMILESCc1ccc(-c2nc3ccccc3n2C)cc1.Cc1ccc(-n2c3ccccc3c3ccccc32)cc1.Cc1ccc(N(c2ccc3ccccc3c2)c2ccc3ccccc3c2)cc1.Cc1ccc(N(c2ccccc2)c2ccc3ccccc3c2)cc1.Cc1ccc(N(c2ccccc2)c2cccc3ccccc23)cc1.Cc1ccc(N(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C27H21N.2C23H19N.C19H15N.C19H17N.C15H14N2/c1-20-10-14-25(15-11-20)28(26-16-12-21-6-2-4-8-23(21)18-26)27-17-13-22-7-3-5-9-24(22)19-27;1-18-14-16-21(17-15-18)24(20-10-3-2-4-11-20)23-13-7-9-19-8-5-6-12-22(19)23;1-18-11-14-22(15-12-18)24(21-9-3-2-4-10-21)23-16-13-19-7-5-6-8-20(19)17-23;1-14-10-12-15(13-11-14)20-18-8-4-2-6-16(18)17-7-3-5-9-19(17)20;1-16-12-14-19(15-13-16)20(17-8-4-2-5-9-17)18-10-6-3-7-11-18;1-11-7-9-12(10-8-11)15-16-13-5-3-4-6-14(13)17(15)2/h2-19H,1H3;2*2-17H,1H3;2-13H,1H3;2-15H,1H3;3-10H,1-2H3
InChIKeyRGUBHWPXEHVZIK-UHFFFAOYSA-N
MW1717.27 g/mol
LogP35.11
Rot. Bonds14

About 4-methyl-N,N-diphenylaniline;1-methyl-2-(4-methylphenyl)benzimidazole;9-(4-methylphenyl)carbazole;N-(4-methylphenyl)-N-naphthalen-2-ylnaphthalen-2-amine;N-(4-methylphenyl)-N-phenylnaphthalen-1-amine;N-(4-methylphenyl)-N-phenylnaphthalen-2-amine

4-methyl-N,N-diphenylaniline;1-methyl-2-(4-methylphenyl)benzimidazole;9-(4-methylphenyl)carbazole;N-(4-methylphenyl)-N-naphthalen-2-ylnaphthalen-2-amine;N-(4-methylphenyl)-N-phenylnaphthalen-1-amine;N-(4-methylphenyl)-N-phenylnaphthalen-2-amine (PubChem CID 160621708) has the molecular formula C126H105N7 and a molecular weight of 1717.27 g/mol. Its IUPAC name is 4-methyl-N,N-diphenylaniline;1-methyl-2-(4-methylphenyl)benzimidazole;9-(4-methylphenyl)carbazole;N-(4-methylphenyl)-N-naphthalen-2-ylnaphthalen-2-amine;N-(4-methylphenyl)-N-phenylnaphthalen-1-amine;N-(4-methylphenyl)-N-phenylnaphthalen-2-amine.

Molecular Properties

Compound Name4-methyl-N,N-diphenylaniline;1-methyl-2-(4-methylphenyl)benzimidazole;9-(4-methylphenyl)carbazole;N-(4-methylphenyl)-N-naphthalen-2-ylnaphthalen-2-amine;N-(4-methylphenyl)-N-phenylnaphthalen-1-amine;N-(4-methylphenyl)-N-phenylnaphthalen-2-amine
PubChem CID160621708
Molecular FormulaC126H105N7
Molecular Weight1717.27 g/mol
Exact Mass1715.84
IUPAC Name4-methyl-N,N-diphenylaniline;1-methyl-2-(4-methylphenyl)benzimidazole;9-(4-methylphenyl)carbazole;N-(4-methylphenyl)-N-naphthalen-2-ylnaphthalen-2-amine;N-(4-methylphenyl)-N-phenylnaphthalen-1-amine;N-(4-methylphenyl)-N-phenylnaphthalen-2-amine
SMILESCc1ccc(-c2nc3ccccc3n2C)cc1.Cc1ccc(-n2c3ccccc3c3ccccc32)cc1.Cc1ccc(N(c2ccc3ccccc3c2)c2ccc3ccccc3c2)cc1.Cc1ccc(N(c2ccccc2)c2ccc3ccccc3c2)cc1.Cc1ccc(N(c2ccccc2)c2cccc3ccccc23)cc1.Cc1ccc(N(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C27H21N.2C23H19N.C19H15N.C19H17N.C15H14N2/c1-20-10-14-25(15-11-20)28(26-16-12-21-6-2-4-8-23(21)18-26)27-17-13-22-7-3-5-9-24(22)19-27;1-18-14-16-21(17-15-18)24(20-10-3-2-4-11-20)23-13-7-9-19-8-5-6-12-22(19)23;1-18-11-14-22(15-12-18)24(21-9-3-2-4-10-21)23-16-13-19-7-5-6-8-20(19)17-23;1-14-10-12-15(13-11-14)20-18-8-4-2-6-16(18)17-7-3-5-9-19(17)20;1-16-12-14-19(15-13-16)20(17-8-4-2-5-9-17)18-10-6-3-7-11-18;1-11-7-9-12(10-8-11)15-16-13-5-3-4-6-14(13)17(15)2/h2-19H,1H3;2*2-17H,1H3;2-13H,1H3;2-15H,1H3;3-10H,1-2H3
InChIKeyRGUBHWPXEHVZIK-UHFFFAOYSA-N
XLogP35.11
TPSA35.71 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds14
Heavy Atoms133
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001717.27
LogP ≤ 535.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 4-methyl-N,N-diphenylaniline;1-methyl-2-(4-methylphenyl)benzimidazole;9-(4-methylphenyl)carbazole;N-(4-methylphenyl)-N-naphthalen-2-ylnaphthalen-2-amine;N-(4-methylphenyl)-N-phenylnaphthalen-1-amine;N-(4-methylphenyl)-N-phenylnaphthalen-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-[4-(4-methyl-N-naphthalen-1-ylanilino)phenyl]naphthalen-1-yl]-N-naphthalen-2-yl-9-phenylcarbazol-3-amine;N-[4-[4-(4-methyl-N-naphthalen-2-ylanilino)phenyl]naphthalen-1-yl]-N-naphthalen-2-yl-9-phenylcarbazol-3-amine;N-naphthalen-2-yl-N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]naphthalen-1-yl]-9-phenylcarbazol-3-amine;N-naphthalen-2-yl-N-[4-[4-(N-naphthalen-2-ylanilino)phenyl]naphthalen-1-yl]-9-phenylcarbazol-3-amine
CID 158479839
N-[4-[4-(dinaphthalen-1-ylamino)phenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine;N-[4-[4-(dinaphthalen-2-ylamino)phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine;N,N-diphenyl-4-[4-(N-phenylanilino)phenyl]aniline;9-phenylcarbazole
CID 158239659
4-(4-carbazol-9-ylphenyl)-N,N-diphenylaniline;4-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-N-phenylaniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N,4-diphenylaniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-phenylnaphthalen-1-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-phenylnaphthalen-2-amine
CID 159528912
N-[4-[4-(4-methyl-N-naphthalen-1-ylanilino)naphthalen-1-yl]phenyl]-N-naphthalen-1-yl-9-phenylcarbazol-3-amine;N-[4-[4-(4-methyl-N-naphthalen-2-ylanilino)naphthalen-1-yl]phenyl]-N-naphthalen-1-yl-9-phenylcarbazol-3-amine;N-naphthalen-1-yl-N-[4-[4-(N-naphthalen-1-ylanilino)naphthalen-1-yl]phenyl]-9-phenylcarbazol-3-amine;N-naphthalen-1-yl-N-[4-[4-(N-naphthalen-2-ylanilino)naphthalen-1-yl]phenyl]-9-phenylcarbazol-3-amine
CID 162093292
N-[4-[4-(4-methyl-N-naphthalen-1-ylanilino)phenyl]naphthalen-1-yl]-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]naphthalen-1-yl]-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine;N-[4-[4-(N-naphthalen-2-ylanilino)phenyl]naphthalen-1-yl]-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine;N-naphthalen-2-yl-9-phenyl-N-[4-[4-(4-phenyl-N-(3-phenylphenyl)anilino)phenyl]naphthalen-1-yl]carbazol-3-amine
CID 161206172
9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;4-N-naphthalen-2-yl-1-N,1-N-bis[4-(N-naphthalen-2-ylanilino)phenyl]-4-N-phenylbenzene-1,4-diamine
CID 159967924
N-[4-[5-[2,3-dimethyl-1-[4-(4-methyl-N-(4-phenylphenyl)anilino)phenyl]indol-5-yl]-2,3-dimethylindol-1-yl]phenyl]-4-methyl-N-(4-phenylphenyl)aniline;N-[4-[5-[2,3-dimethyl-1-[4-[naphthalen-1-yl(naphthalen-2-yl)amino]phenyl]indol-5-yl]-2,3-dimethylindol-1-yl]phenyl]-N-naphthalen-1-ylnaphthalen-2-amine;N-[4-[5-[2,3-dimethyl-1-[4-(N-(4-phenylphenyl)anilino)phenyl]indol-5-yl]-2,3-dimethylindol-1-yl]phenyl]-N,4-diphenylaniline
CID 158168687
N-(4-methylphenyl)-N-phenylnaphthalen-1-amine;N-(4-methylphenyl)-N-phenylnaphthalen-2-amine;N-(4-methylphenyl)-N-(4-phenylphenyl)naphthalen-1-amine;N-(4-methylphenyl)-N-(4-phenylphenyl)naphthalen-2-amine
CID 161406652
1-N-[4-(4-methylphenyl)phenyl]-4-N,4-N-dinaphthalen-2-yl-1-N-phenylbenzene-1,4-diamine;4-N-[4-(4-methylphenyl)phenyl]-1-N,4-N-dinaphthalen-1-yl-1-N-phenylbenzene-1,4-diamine;4-N-[4-(4-methylphenyl)phenyl]-4-N-naphthalen-1-yl-1-N,1-N-diphenylbenzene-1,4-diamine;1-N-[4-(4-methylphenyl)phenyl]-4-N-naphthalen-1-yl-4-N-naphthalen-2-yl-1-N-phenylbenzene-1,4-diamine
CID 157265115
3,6-bis(4-carbazol-9-ylphenyl)-9-naphthalen-2-ylcarbazole;N-[4-[6-[4-(N-naphthalen-1-ylanilino)phenyl]-9-phenylcarbazol-3-yl]phenyl]-N-phenylnaphthalen-1-amine;4-[9-naphthalen-2-yl-6-[4-(N-phenylanilino)phenyl]carbazol-3-yl]-N,N-diphenylaniline;N-[4-[9-naphthalen-2-yl-6-[4-(N-(4-phenylphenyl)anilino)phenyl]carbazol-3-yl]phenyl]-N,4-diphenylaniline
CID 158432139
9-(4-naphthalen-2-ylphenyl)-N-phenyl-N-[4-(1-phenylbenzimidazol-2-yl)phenyl]carbazol-3-amine
CID 59500896
3-N-naphthalen-1-yl-1-N-naphthalen-2-yl-1-N,3-N-diphenyl-5-[4-(9-phenylcarbazol-3-yl)phenyl]benzene-1,3-diamine
CID 129256040

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N,N-diphenylaniline;1-methyl-2-(4-methylphenyl)benzimidazole;9-(4-methylphenyl)carbazole;N-(4-methylphenyl)-N-naphthalen-2-ylnaphthalen-2-amine;N-(4-methylphenyl)-N-phenylnaphthalen-1-amine;N-(4-methylphenyl)-N-phenylnaphthalen-2-amine?
The IUPAC name of 4-methyl-N,N-diphenylaniline;1-methyl-2-(4-methylphenyl)benzimidazole;9-(4-methylphenyl)carbazole;N-(4-methylphenyl)-N-naphthalen-2-ylnaphthalen-2-amine;N-(4-methylphenyl)-N-phenylnaphthalen-1-amine;N-(4-methylphenyl)-N-phenylnaphthalen-2-amine (CID 160621708) is 4-methyl-N,N-diphenylaniline;1-methyl-2-(4-methylphenyl)benzimidazole;9-(4-methylphenyl)carbazole;N-(4-methylphenyl)-N-naphthalen-2-ylnaphthalen-2-amine;N-(4-methylphenyl)-N-phenylnaphthalen-1-amine;N-(4-methylphenyl)-N-phenylnaphthalen-2-amine.
What is the SMILES notation for 4-methyl-N,N-diphenylaniline;1-methyl-2-(4-methylphenyl)benzimidazole;9-(4-methylphenyl)carbazole;N-(4-methylphenyl)-N-naphthalen-2-ylnaphthalen-2-amine;N-(4-methylphenyl)-N-phenylnaphthalen-1-amine;N-(4-methylphenyl)-N-phenylnaphthalen-2-amine?
The canonical SMILES for 4-methyl-N,N-diphenylaniline;1-methyl-2-(4-methylphenyl)benzimidazole;9-(4-methylphenyl)carbazole;N-(4-methylphenyl)-N-naphthalen-2-ylnaphthalen-2-amine;N-(4-methylphenyl)-N-phenylnaphthalen-1-amine;N-(4-methylphenyl)-N-phenylnaphthalen-2-amine is Cc1ccc(-c2nc3ccccc3n2C)cc1.Cc1ccc(-n2c3ccccc3c3ccccc32)cc1.Cc1ccc(N(c2ccc3ccccc3c2)c2ccc3ccccc3c2)cc1.Cc1ccc(N(c2ccccc2)c2ccc3ccccc3c2)cc1.Cc1ccc(N(c2ccccc2)c2cccc3ccccc23)cc1.Cc1ccc(N(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 4-methyl-N,N-diphenylaniline;1-methyl-2-(4-methylphenyl)benzimidazole;9-(4-methylphenyl)carbazole;N-(4-methylphenyl)-N-naphthalen-2-ylnaphthalen-2-amine;N-(4-methylphenyl)-N-phenylnaphthalen-1-amine;N-(4-methylphenyl)-N-phenylnaphthalen-2-amine?
The InChIKey is RGUBHWPXEHVZIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H21N.2C23H19N.C19H15N.C19H17N.C15H14N2/c1-20-10-14-25(15-11-20)28(26-16-12-21-6-2-4-8-23(21)18-26)27-17-13-22-7-3-5-9-24(22)19-27;1-18-14-16-21(17-15-18)24(20-10-3-2-4-11-20)23-13-7-9-19-8-5-6-12-22(19)23;1-18-11-14-22(15-12-18)24(21-9-3-2-4-10-21)23-16-13-19-7-5-6-8-20(19)17-23;1-14-10-12-15(13-11-14)20-18-8-4-2-6-16(18)17-7-3-5-9-19(17)20;1-16-12-14-19(15-13-16)20(17-8-4-2-5-9-17)18-10-6-3-7-11-18;1-11-7-9-12(10-8-11)15-16-13-5-3-4-6-14(13)17(15)2/h2-19H,1H3;2*2-17H,1H3;2-13H,1H3;2-15H,1H3;3-10H,1-2H3.
What are the key properties of 4-methyl-N,N-diphenylaniline;1-methyl-2-(4-methylphenyl)benzimidazole;9-(4-methylphenyl)carbazole;N-(4-methylphenyl)-N-naphthalen-2-ylnaphthalen-2-amine;N-(4-methylphenyl)-N-phenylnaphthalen-1-amine;N-(4-methylphenyl)-N-phenylnaphthalen-2-amine?
4-methyl-N,N-diphenylaniline;1-methyl-2-(4-methylphenyl)benzimidazole;9-(4-methylphenyl)carbazole;N-(4-methylphenyl)-N-naphthalen-2-ylnaphthalen-2-amine;N-(4-methylphenyl)-N-phenylnaphthalen-1-amine;N-(4-methylphenyl)-N-phenylnaphthalen-2-amine has a molecular weight of 1717.27 g/mol, XLogP of 35.11, 14 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N,N-diphenylaniline;1-methyl-2-(4-methylphenyl)benzimidazole;9-(4-methylphenyl)carbazole;N-(4-methylphenyl)-N-naphthalen-2-ylnaphthalen-2-amine;N-(4-methylphenyl)-N-phenylnaphthalen-1-amine;N-(4-methylphenyl)-N-phenylnaphthalen-2-amine is sourced from PubChem (CID 160621708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).