N-(9,9-dimethylfluoren-2-yl)-N-(4-methylphenyl)phenanthren-9-amine;9,9-dimethyl-N-(4-methylphenyl)-N-naphthalen-2-ylfluoren-2-amine;9,9-dimethyl-N-(4-methylphenyl)-N-(2-phenylphenyl)fluoren-2-amine;4-methyl-N,N-bis(4-phenylphenyl)aniline

C133H110N4 — CID 158535588

About N-(9,9-dimethylfluoren-2-yl)-N-(4-methylphenyl)phenanthren-9-amine;9,9-dimethyl-N-(4-methylphenyl)-N-naphthalen-2-ylfluoren-2-amine;9,9-dimethyl-N-(4-methylphenyl)-N-(2-phenylphenyl)fluoren-2-amine;4-methyl-N,N-bis(4-phenylphenyl)aniline

N-(9,9-dimethylfluoren-2-yl)-N-(4-methylphenyl)phenanthren-9-amine;9,9-dimethyl-N-(4-methylphenyl)-N-naphthalen-2-ylfluoren-2-amine;9,9-dimethyl-N-(4-methylphenyl)-N-(2-phenylphenyl)fluoren-2-amine;4-methyl-N,N-bis(4-phenylphenyl)aniline (PubChem CID 158535588) has the molecular formula C133H110N4 and a molecular weight of 1764.37 g/mol. Its IUPAC name is N-(9,9-dimethylfluoren-2-yl)-N-(4-methylphenyl)phenanthren-9-amine;9,9-dimethyl-N-(4-methylphenyl)-N-naphthalen-2-ylfluoren-2-amine;9,9-dimethyl-N-(4-methylphenyl)-N-(2-phenylphenyl)fluoren-2-amine;4-methyl-N,N-bis(4-phenylphenyl)aniline.

Molecular Properties

• Compound Name: N-(9,9-dimethylfluoren-2-yl)-N-(4-methylphenyl)phenanthren-9-amine;9,9-dimethyl-N-(4-methylphenyl)-N-naphthalen-2-ylfluoren-2-amine;9,9-dimethyl-N-(4-methylphenyl)-N-(2-phenylphenyl)fluoren-2-amine;4-methyl-N,N-bis(4-phenylphenyl)aniline
• PubChem CID: 158535588
• Molecular Formula: C133H110N4
• Molecular Weight: 1764.37 g/mol
• Exact Mass: 1762.87
• IUPAC Name: N-(9,9-dimethylfluoren-2-yl)-N-(4-methylphenyl)phenanthren-9-amine;9,9-dimethyl-N-(4-methylphenyl)-N-naphthalen-2-ylfluoren-2-amine;9,9-dimethyl-N-(4-methylphenyl)-N-(2-phenylphenyl)fluoren-2-amine;4-methyl-N,N-bis(4-phenylphenyl)aniline
• SMILES: Cc1ccc(N(c2ccc(-c3ccccc3)cc2)c2ccc(-c3ccccc3)cc2)cc1.Cc1ccc(N(c2ccc3c(c2)C(C)(C)c2ccccc2-3)c2cc3ccccc3c3ccccc23)cc1.Cc1ccc(N(c2ccc3c(c2)C(C)(C)c2ccccc2-3)c2ccc3ccccc3c2)cc1.Cc1ccc(N(c2ccc3c(c2)C(C)(C)c2ccccc2-3)c2ccccc2-c2ccccc2)cc1
• InChI: InChI=1S/C36H29N.C34H29N.C32H27N.C31H25N/c1-24-16-18-26(19-17-24)37(35-22-25-10-4-5-11-28(25)29-12-6-7-14-32(29)35)27-20-21-31-30-13-8-9-15-33(30)36(2,3)34(31)23-27;1-24-17-19-26(20-18-24)35(33-16-10-8-13-28(33)25-11-5-4-6-12-25)27-21-22-30-29-14-7-9-15-31(29)34(2,3)32(30)23-27;1-22-12-15-25(16-13-22)33(26-17-14-23-8-4-5-9-24(23)20-26)27-18-19-29-28-10-6-7-11-30(28)32(2,3)31(29)21-27;1-24-12-18-29(19-13-24)32(30-20-14-27(15-21-30)25-8-4-2-5-9-25)31-22-16-28(17-23-31)26-10-6-3-7-11-26/h4-23H,1-3H3;4-23H,1-3H3;4-21H,1-3H3;2-23H,1H3
• InChIKey: HNXFKANKCNKNRE-UHFFFAOYSA-N
• XLogP: 37.24
• TPSA: 12.96 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 15
• Heavy Atoms: 137
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1764.37
LogP ≤ 5	37.24
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-(9,9-dimethylfluoren-2-yl)-N-(4-methylphenyl)phenanthren-9-amine;9,9-dimethyl-N-(4-methylphenyl)-N-naphthalen-2-ylfluoren-2-amine;9,9-dimethyl-N-(4-methylphenyl)-N-(2-phenylphenyl)fluoren-2-amine;4-methyl-N,N-bis(4-phenylphenyl)aniline?

The IUPAC name of N-(9,9-dimethylfluoren-2-yl)-N-(4-methylphenyl)phenanthren-9-amine;9,9-dimethyl-N-(4-methylphenyl)-N-naphthalen-2-ylfluoren-2-amine;9,9-dimethyl-N-(4-methylphenyl)-N-(2-phenylphenyl)fluoren-2-amine;4-methyl-N,N-bis(4-phenylphenyl)aniline (CID 158535588) is N-(9,9-dimethylfluoren-2-yl)-N-(4-methylphenyl)phenanthren-9-amine;9,9-dimethyl-N-(4-methylphenyl)-N-naphthalen-2-ylfluoren-2-amine;9,9-dimethyl-N-(4-methylphenyl)-N-(2-phenylphenyl)fluoren-2-amine;4-methyl-N,N-bis(4-phenylphenyl)aniline.

What is the SMILES notation for N-(9,9-dimethylfluoren-2-yl)-N-(4-methylphenyl)phenanthren-9-amine;9,9-dimethyl-N-(4-methylphenyl)-N-naphthalen-2-ylfluoren-2-amine;9,9-dimethyl-N-(4-methylphenyl)-N-(2-phenylphenyl)fluoren-2-amine;4-methyl-N,N-bis(4-phenylphenyl)aniline?

The canonical SMILES for N-(9,9-dimethylfluoren-2-yl)-N-(4-methylphenyl)phenanthren-9-amine;9,9-dimethyl-N-(4-methylphenyl)-N-naphthalen-2-ylfluoren-2-amine;9,9-dimethyl-N-(4-methylphenyl)-N-(2-phenylphenyl)fluoren-2-amine;4-methyl-N,N-bis(4-phenylphenyl)aniline is Cc1ccc(N(c2ccc(-c3ccccc3)cc2)c2ccc(-c3ccccc3)cc2)cc1.Cc1ccc(N(c2ccc3c(c2)C(C)(C)c2ccccc2-3)c2cc3ccccc3c3ccccc23)cc1.Cc1ccc(N(c2ccc3c(c2)C(C)(C)c2ccccc2-3)c2ccc3ccccc3c2)cc1.Cc1ccc(N(c2ccc3c(c2)C(C)(C)c2ccccc2-3)c2ccccc2-c2ccccc2)cc1.

What is the InChIKey of N-(9,9-dimethylfluoren-2-yl)-N-(4-methylphenyl)phenanthren-9-amine;9,9-dimethyl-N-(4-methylphenyl)-N-naphthalen-2-ylfluoren-2-amine;9,9-dimethyl-N-(4-methylphenyl)-N-(2-phenylphenyl)fluoren-2-amine;4-methyl-N,N-bis(4-phenylphenyl)aniline?

The InChIKey is HNXFKANKCNKNRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H29N.C34H29N.C32H27N.C31H25N/c1-24-16-18-26(19-17-24)37(35-22-25-10-4-5-11-28(25)29-12-6-7-14-32(29)35)27-20-21-31-30-13-8-9-15-33(30)36(2,3)34(31)23-27;1-24-17-19-26(20-18-24)35(33-16-10-8-13-28(33)25-11-5-4-6-12-25)27-21-22-30-29-14-7-9-15-31(29)34(2,3)32(30)23-27;1-22-12-15-25(16-13-22)33(26-17-14-23-8-4-5-9-24(23)20-26)27-18-19-29-28-10-6-7-11-30(28)32(2,3)31(29)21-27;1-24-12-18-29(19-13-24)32(30-20-14-27(15-21-30)25-8-4-2-5-9-25)31-22-16-28(17-23-31)26-10-6-3-7-11-26/h4-23H,1-3H3;4-23H,1-3H3;4-21H,1-3H3;2-23H,1H3.

What are the key properties of N-(9,9-dimethylfluoren-2-yl)-N-(4-methylphenyl)phenanthren-9-amine;9,9-dimethyl-N-(4-methylphenyl)-N-naphthalen-2-ylfluoren-2-amine;9,9-dimethyl-N-(4-methylphenyl)-N-(2-phenylphenyl)fluoren-2-amine;4-methyl-N,N-bis(4-phenylphenyl)aniline?

N-(9,9-dimethylfluoren-2-yl)-N-(4-methylphenyl)phenanthren-9-amine;9,9-dimethyl-N-(4-methylphenyl)-N-naphthalen-2-ylfluoren-2-amine;9,9-dimethyl-N-(4-methylphenyl)-N-(2-phenylphenyl)fluoren-2-amine;4-methyl-N,N-bis(4-phenylphenyl)aniline has a molecular weight of 1764.37 g/mol, XLogP of 37.24, 15 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-(9,9-dimethylfluoren-2-yl)-N-(4-methylphenyl)phenanthren-9-amine;9,9-dimethyl-N-(4-methylphenyl)-N-naphthalen-2-ylfluoren-2-amine;9,9-dimethyl-N-(4-methylphenyl)-N-(2-phenylphenyl)fluoren-2-amine;4-methyl-N,N-bis(4-phenylphenyl)aniline is sourced from PubChem (CID 158535588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).