N,N-diphenyl-4-[3-phenyl-5-(4-phenylphenyl)pyrazol-1-yl]aniline;4-[5-(4-naphthalen-1-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-[5-(4-naphthalen-2-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-(5-naphthalen-2-yl-3-phenylpyrazol-1-yl)-N,N-diphenylaniline

C162H118N12 — CID 158218297

About N,N-diphenyl-4-[3-phenyl-5-(4-phenylphenyl)pyrazol-1-yl]aniline;4-[5-(4-naphthalen-1-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-[5-(4-naphthalen-2-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-(5-naphthalen-2-yl-3-phenylpyrazol-1-yl)-N,N-diphenylaniline

N,N-diphenyl-4-[3-phenyl-5-(4-phenylphenyl)pyrazol-1-yl]aniline;4-[5-(4-naphthalen-1-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-[5-(4-naphthalen-2-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-(5-naphthalen-2-yl-3-phenylpyrazol-1-yl)-N,N-diphenylaniline (PubChem CID 158218297) has the molecular formula C162H118N12 and a molecular weight of 2232.81 g/mol. Its IUPAC name is N,N-diphenyl-4-[3-phenyl-5-(4-phenylphenyl)pyrazol-1-yl]aniline;4-[5-(4-naphthalen-1-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-[5-(4-naphthalen-2-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-(5-naphthalen-2-yl-3-phenylpyrazol-1-yl)-N,N-diphenylaniline.

Molecular Properties

• Compound Name: N,N-diphenyl-4-[3-phenyl-5-(4-phenylphenyl)pyrazol-1-yl]aniline;4-[5-(4-naphthalen-1-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-[5-(4-naphthalen-2-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-(5-naphthalen-2-yl-3-phenylpyrazol-1-yl)-N,N-diphenylaniline
• PubChem CID: 158218297
• Molecular Formula: C162H118N12
• Molecular Weight: 2232.81 g/mol
• Exact Mass: 2230.96
• IUPAC Name: N,N-diphenyl-4-[3-phenyl-5-(4-phenylphenyl)pyrazol-1-yl]aniline;4-[5-(4-naphthalen-1-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-[5-(4-naphthalen-2-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-(5-naphthalen-2-yl-3-phenylpyrazol-1-yl)-N,N-diphenylaniline
• SMILES: c1ccc(-c2cc(-c3ccc(-c4ccc5ccccc5c4)cc3)n(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)n2)cc1.c1ccc(-c2cc(-c3ccc(-c4cccc5ccccc45)cc3)n(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)n2)cc1.c1ccc(-c2cc(-c3ccc4ccccc4c3)n(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)n2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccccc4)nn3-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1
• InChI: InChI=1S/2C43H31N3.C39H29N3.C37H27N3/c1-4-14-34(15-5-1)42-31-43(35-25-23-33(24-26-35)41-22-12-16-32-13-10-11-21-40(32)41)46(44-42)39-29-27-38(28-30-39)45(36-17-6-2-7-18-36)37-19-8-3-9-20-37;1-4-13-34(14-5-1)42-31-43(35-23-20-33(21-24-35)37-25-22-32-12-10-11-15-36(32)30-37)46(44-42)41-28-26-40(27-29-41)45(38-16-6-2-7-17-38)39-18-8-3-9-19-39;1-5-13-30(14-6-1)31-21-23-33(24-22-31)39-29-38(32-15-7-2-8-16-32)40-42(39)37-27-25-36(26-28-37)41(34-17-9-3-10-18-34)35-19-11-4-12-20-35;1-4-13-29(14-5-1)36-27-37(31-21-20-28-12-10-11-15-30(28)26-31)40(38-36)35-24-22-34(23-25-35)39(32-16-6-2-7-17-32)33-18-8-3-9-19-33/h2*1-31H;1-29H;1-27H
• InChIKey: GCXXPBBEUXESEB-UHFFFAOYSA-N
• XLogP: 43.17
• TPSA: 84.24 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 27
• Heavy Atoms: 174
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2232.81
LogP ≤ 5	43.17
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of N,N-diphenyl-4-[3-phenyl-5-(4-phenylphenyl)pyrazol-1-yl]aniline;4-[5-(4-naphthalen-1-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-[5-(4-naphthalen-2-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-(5-naphthalen-2-yl-3-phenylpyrazol-1-yl)-N,N-diphenylaniline?

The IUPAC name of N,N-diphenyl-4-[3-phenyl-5-(4-phenylphenyl)pyrazol-1-yl]aniline;4-[5-(4-naphthalen-1-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-[5-(4-naphthalen-2-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-(5-naphthalen-2-yl-3-phenylpyrazol-1-yl)-N,N-diphenylaniline (CID 158218297) is N,N-diphenyl-4-[3-phenyl-5-(4-phenylphenyl)pyrazol-1-yl]aniline;4-[5-(4-naphthalen-1-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-[5-(4-naphthalen-2-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-(5-naphthalen-2-yl-3-phenylpyrazol-1-yl)-N,N-diphenylaniline.

What is the SMILES notation for N,N-diphenyl-4-[3-phenyl-5-(4-phenylphenyl)pyrazol-1-yl]aniline;4-[5-(4-naphthalen-1-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-[5-(4-naphthalen-2-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-(5-naphthalen-2-yl-3-phenylpyrazol-1-yl)-N,N-diphenylaniline?

The canonical SMILES for N,N-diphenyl-4-[3-phenyl-5-(4-phenylphenyl)pyrazol-1-yl]aniline;4-[5-(4-naphthalen-1-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-[5-(4-naphthalen-2-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-(5-naphthalen-2-yl-3-phenylpyrazol-1-yl)-N,N-diphenylaniline is c1ccc(-c2cc(-c3ccc(-c4ccc5ccccc5c4)cc3)n(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)n2)cc1.c1ccc(-c2cc(-c3ccc(-c4cccc5ccccc45)cc3)n(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)n2)cc1.c1ccc(-c2cc(-c3ccc4ccccc4c3)n(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)n2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccccc4)nn3-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1.

What is the InChIKey of N,N-diphenyl-4-[3-phenyl-5-(4-phenylphenyl)pyrazol-1-yl]aniline;4-[5-(4-naphthalen-1-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-[5-(4-naphthalen-2-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-(5-naphthalen-2-yl-3-phenylpyrazol-1-yl)-N,N-diphenylaniline?

The InChIKey is GCXXPBBEUXESEB-UHFFFAOYSA-N. The full InChI is InChI=1S/2C43H31N3.C39H29N3.C37H27N3/c1-4-14-34(15-5-1)42-31-43(35-25-23-33(24-26-35)41-22-12-16-32-13-10-11-21-40(32)41)46(44-42)39-29-27-38(28-30-39)45(36-17-6-2-7-18-36)37-19-8-3-9-20-37;1-4-13-34(14-5-1)42-31-43(35-23-20-33(21-24-35)37-25-22-32-12-10-11-15-36(32)30-37)46(44-42)41-28-26-40(27-29-41)45(38-16-6-2-7-17-38)39-18-8-3-9-19-39;1-5-13-30(14-6-1)31-21-23-33(24-22-31)39-29-38(32-15-7-2-8-16-32)40-42(39)37-27-25-36(26-28-37)41(34-17-9-3-10-18-34)35-19-11-4-12-20-35;1-4-13-29(14-5-1)36-27-37(31-21-20-28-12-10-11-15-30(28)26-31)40(38-36)35-24-22-34(23-25-35)39(32-16-6-2-7-17-32)33-18-8-3-9-19-33/h2*1-31H;1-29H;1-27H.

What are the key properties of N,N-diphenyl-4-[3-phenyl-5-(4-phenylphenyl)pyrazol-1-yl]aniline;4-[5-(4-naphthalen-1-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-[5-(4-naphthalen-2-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-(5-naphthalen-2-yl-3-phenylpyrazol-1-yl)-N,N-diphenylaniline?

N,N-diphenyl-4-[3-phenyl-5-(4-phenylphenyl)pyrazol-1-yl]aniline;4-[5-(4-naphthalen-1-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-[5-(4-naphthalen-2-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-(5-naphthalen-2-yl-3-phenylpyrazol-1-yl)-N,N-diphenylaniline has a molecular weight of 2232.81 g/mol, XLogP of 43.17, 27 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for N,N-diphenyl-4-[3-phenyl-5-(4-phenylphenyl)pyrazol-1-yl]aniline;4-[5-(4-naphthalen-1-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-[5-(4-naphthalen-2-ylphenyl)-3-phenylpyrazol-1-yl]-N,N-diphenylaniline;4-(5-naphthalen-2-yl-3-phenylpyrazol-1-yl)-N,N-diphenylaniline is sourced from PubChem (CID 158218297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).