7-carbazol-9-yl-N-(4-carbazol-9-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-3,4-dihydrofluoren-2-amine

C69H50N4 — CID 159412665

About 7-carbazol-9-yl-N-(4-carbazol-9-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-3,4-dihydrofluoren-2-amine

7-carbazol-9-yl-N-(4-carbazol-9-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-3,4-dihydrofluoren-2-amine (PubChem CID 159412665) has the molecular formula C69H50N4 and a molecular weight of 935.19 g/mol. Its IUPAC name is 7-carbazol-9-yl-N-(4-carbazol-9-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-3,4-dihydrofluoren-2-amine.

Molecular Properties

• Compound Name: 7-carbazol-9-yl-N-(4-carbazol-9-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-3,4-dihydrofluoren-2-amine
• PubChem CID: 159412665
• Molecular Formula: C69H50N4
• Molecular Weight: 935.19 g/mol
• Exact Mass: 934.40
• IUPAC Name: 7-carbazol-9-yl-N-(4-carbazol-9-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-3,4-dihydrofluoren-2-amine
• SMILES: CC1(C)C2=C(CCC(N(c3ccc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)cc3)c3ccc(-n4c5ccccc5c5ccccc54)cc3)=C2)c2ccc(-n3c4ccccc4c4ccccc43)cc21
• InChI: InChI=1S/C69H50N4/c1-69(2)61-43-51(37-40-53(61)54-41-38-52(44-62(54)69)73-66-26-14-8-20-57(66)58-21-9-15-27-67(58)73)70(49-33-35-50(36-34-49)71-63-23-11-6-18-55(63)56-19-7-12-24-64(56)71)48-31-28-45(29-32-48)46-30-39-60-59-22-10-13-25-65(59)72(68(60)42-46)47-16-4-3-5-17-47/h3-36,38-39,41-44H,37,40H2,1-2H3
• InChIKey: LOTRQTDJLJHPCE-UHFFFAOYSA-N
• XLogP: 18.21
• TPSA: 18.03 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 7
• Heavy Atoms: 73
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	935.19
LogP ≤ 5	18.21
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 7-carbazol-9-yl-N-(4-carbazol-9-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-3,4-dihydrofluoren-2-amine?

The IUPAC name of 7-carbazol-9-yl-N-(4-carbazol-9-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-3,4-dihydrofluoren-2-amine (CID 159412665) is 7-carbazol-9-yl-N-(4-carbazol-9-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-3,4-dihydrofluoren-2-amine.

What is the SMILES notation for 7-carbazol-9-yl-N-(4-carbazol-9-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-3,4-dihydrofluoren-2-amine?

The canonical SMILES for 7-carbazol-9-yl-N-(4-carbazol-9-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-3,4-dihydrofluoren-2-amine is CC1(C)C2=C(CCC(N(c3ccc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)cc3)c3ccc(-n4c5ccccc5c5ccccc54)cc3)=C2)c2ccc(-n3c4ccccc4c4ccccc43)cc21.

What is the InChIKey of 7-carbazol-9-yl-N-(4-carbazol-9-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-3,4-dihydrofluoren-2-amine?

The InChIKey is LOTRQTDJLJHPCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C69H50N4/c1-69(2)61-43-51(37-40-53(61)54-41-38-52(44-62(54)69)73-66-26-14-8-20-57(66)58-21-9-15-27-67(58)73)70(49-33-35-50(36-34-49)71-63-23-11-6-18-55(63)56-19-7-12-24-64(56)71)48-31-28-45(29-32-48)46-30-39-60-59-22-10-13-25-65(59)72(68(60)42-46)47-16-4-3-5-17-47/h3-36,38-39,41-44H,37,40H2,1-2H3.

What are the key properties of 7-carbazol-9-yl-N-(4-carbazol-9-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-3,4-dihydrofluoren-2-amine?

7-carbazol-9-yl-N-(4-carbazol-9-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-3,4-dihydrofluoren-2-amine has a molecular weight of 935.19 g/mol, XLogP of 18.21, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 7-carbazol-9-yl-N-(4-carbazol-9-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-3,4-dihydrofluoren-2-amine is sourced from PubChem (CID 159412665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).