N-[4-[4-(dinaphthalen-1-ylamino)phenyl]phenyl]-N-methylnaphthalen-1-amine;N-[4-[4-(N-methylanilino)phenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine;3-[N-methyl-4-[4-(N-(3-phenylphenyl)anilino)phenyl]anilino]benzonitrile

C120H91N7 — CID 159177333

About N-[4-[4-(dinaphthalen-1-ylamino)phenyl]phenyl]-N-methylnaphthalen-1-amine;N-[4-[4-(N-methylanilino)phenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine;3-[N-methyl-4-[4-(N-(3-phenylphenyl)anilino)phenyl]anilino]benzonitrile

N-[4-[4-(dinaphthalen-1-ylamino)phenyl]phenyl]-N-methylnaphthalen-1-amine;N-[4-[4-(N-methylanilino)phenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine;3-[N-methyl-4-[4-(N-(3-phenylphenyl)anilino)phenyl]anilino]benzonitrile (PubChem CID 159177333) has the molecular formula C120H91N7 and a molecular weight of 1631.10 g/mol. Its IUPAC name is N-[4-[4-(dinaphthalen-1-ylamino)phenyl]phenyl]-N-methylnaphthalen-1-amine;N-[4-[4-(N-methylanilino)phenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine;3-[N-methyl-4-[4-(N-(3-phenylphenyl)anilino)phenyl]anilino]benzonitrile.

Molecular Properties

• Compound Name: N-[4-[4-(dinaphthalen-1-ylamino)phenyl]phenyl]-N-methylnaphthalen-1-amine;N-[4-[4-(N-methylanilino)phenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine;3-[N-methyl-4-[4-(N-(3-phenylphenyl)anilino)phenyl]anilino]benzonitrile
• PubChem CID: 159177333
• Molecular Formula: C120H91N7
• Molecular Weight: 1631.10 g/mol
• Exact Mass: 1629.73
• IUPAC Name: N-[4-[4-(dinaphthalen-1-ylamino)phenyl]phenyl]-N-methylnaphthalen-1-amine;N-[4-[4-(N-methylanilino)phenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine;3-[N-methyl-4-[4-(N-(3-phenylphenyl)anilino)phenyl]anilino]benzonitrile
• SMILES: CN(c1ccc(-c2ccc(N(c3cccc4ccccc34)c3cccc4ccccc34)cc2)cc1)c1cccc2ccccc12.CN(c1ccc(-c2ccc(N(c3ccccc3)c3cccc(-c4ccccc4)c3)cc2)cc1)c1cccc(C#N)c1.CN(c1ccccc1)c1ccc(-c2ccc(N(c3cccc4ccccc34)c3cccc4ccccc34)cc2)cc1
• InChI: InChI=1S/C43H32N2.C39H30N2.C38H29N3/c1-44(41-20-8-14-33-11-2-5-17-38(33)41)36-27-23-31(24-28-36)32-25-29-37(30-26-32)45(42-21-9-15-34-12-3-6-18-39(34)42)43-22-10-16-35-13-4-7-19-40(35)43;1-40(33-15-3-2-4-16-33)34-25-21-29(22-26-34)30-23-27-35(28-24-30)41(38-19-9-13-31-11-5-7-17-36(31)38)39-20-10-14-32-12-6-8-18-37(32)39;1-40(37-16-8-10-29(26-37)28-39)34-22-18-31(19-23-34)32-20-24-36(25-21-32)41(35-14-6-3-7-15-35)38-17-9-13-33(27-38)30-11-4-2-5-12-30/h2-30H,1H3;2-28H,1H3;2-27H,1H3
• InChIKey: KMLDYEVJKFLFJT-UHFFFAOYSA-N
• XLogP: 33.08
• TPSA: 43.23 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 19
• Heavy Atoms: 127
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1631.10
LogP ≤ 5	33.08
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-(dinaphthalen-1-ylamino)phenyl]phenyl]-N-methylnaphthalen-1-amine;N-[4-[4-(N-methylanilino)phenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine;3-[N-methyl-4-[4-(N-(3-phenylphenyl)anilino)phenyl]anilino]benzonitrile?

The IUPAC name of N-[4-[4-(dinaphthalen-1-ylamino)phenyl]phenyl]-N-methylnaphthalen-1-amine;N-[4-[4-(N-methylanilino)phenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine;3-[N-methyl-4-[4-(N-(3-phenylphenyl)anilino)phenyl]anilino]benzonitrile (CID 159177333) is N-[4-[4-(dinaphthalen-1-ylamino)phenyl]phenyl]-N-methylnaphthalen-1-amine;N-[4-[4-(N-methylanilino)phenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine;3-[N-methyl-4-[4-(N-(3-phenylphenyl)anilino)phenyl]anilino]benzonitrile.

What is the SMILES notation for N-[4-[4-(dinaphthalen-1-ylamino)phenyl]phenyl]-N-methylnaphthalen-1-amine;N-[4-[4-(N-methylanilino)phenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine;3-[N-methyl-4-[4-(N-(3-phenylphenyl)anilino)phenyl]anilino]benzonitrile?

The canonical SMILES for N-[4-[4-(dinaphthalen-1-ylamino)phenyl]phenyl]-N-methylnaphthalen-1-amine;N-[4-[4-(N-methylanilino)phenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine;3-[N-methyl-4-[4-(N-(3-phenylphenyl)anilino)phenyl]anilino]benzonitrile is CN(c1ccc(-c2ccc(N(c3cccc4ccccc34)c3cccc4ccccc34)cc2)cc1)c1cccc2ccccc12.CN(c1ccc(-c2ccc(N(c3ccccc3)c3cccc(-c4ccccc4)c3)cc2)cc1)c1cccc(C#N)c1.CN(c1ccccc1)c1ccc(-c2ccc(N(c3cccc4ccccc34)c3cccc4ccccc34)cc2)cc1.

What is the InChIKey of N-[4-[4-(dinaphthalen-1-ylamino)phenyl]phenyl]-N-methylnaphthalen-1-amine;N-[4-[4-(N-methylanilino)phenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine;3-[N-methyl-4-[4-(N-(3-phenylphenyl)anilino)phenyl]anilino]benzonitrile?

The InChIKey is KMLDYEVJKFLFJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H32N2.C39H30N2.C38H29N3/c1-44(41-20-8-14-33-11-2-5-17-38(33)41)36-27-23-31(24-28-36)32-25-29-37(30-26-32)45(42-21-9-15-34-12-3-6-18-39(34)42)43-22-10-16-35-13-4-7-19-40(35)43;1-40(33-15-3-2-4-16-33)34-25-21-29(22-26-34)30-23-27-35(28-24-30)41(38-19-9-13-31-11-5-7-17-36(31)38)39-20-10-14-32-12-6-8-18-37(32)39;1-40(37-16-8-10-29(26-37)28-39)34-22-18-31(19-23-34)32-20-24-36(25-21-32)41(35-14-6-3-7-15-35)38-17-9-13-33(27-38)30-11-4-2-5-12-30/h2-30H,1H3;2-28H,1H3;2-27H,1H3.

What are the key properties of N-[4-[4-(dinaphthalen-1-ylamino)phenyl]phenyl]-N-methylnaphthalen-1-amine;N-[4-[4-(N-methylanilino)phenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine;3-[N-methyl-4-[4-(N-(3-phenylphenyl)anilino)phenyl]anilino]benzonitrile?

N-[4-[4-(dinaphthalen-1-ylamino)phenyl]phenyl]-N-methylnaphthalen-1-amine;N-[4-[4-(N-methylanilino)phenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine;3-[N-methyl-4-[4-(N-(3-phenylphenyl)anilino)phenyl]anilino]benzonitrile has a molecular weight of 1631.10 g/mol, XLogP of 33.08, 19 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-[4-(dinaphthalen-1-ylamino)phenyl]phenyl]-N-methylnaphthalen-1-amine;N-[4-[4-(N-methylanilino)phenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine;3-[N-methyl-4-[4-(N-(3-phenylphenyl)anilino)phenyl]anilino]benzonitrile is sourced from PubChem (CID 159177333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).