9-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)carbazol-3-amine

C43H28N2 — CID 146332882

IUPAC9-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)carbazol-3-amine
SMILESc1ccc(-n2c3ccccc3c3cc(Nc4cccc5c4-c4ccccc4C54c5ccccc5-c5ccccc54)ccc32)cc1
InChIInChI=1S/C43H28N2/c1-2-13-29(14-3-1)45-40-24-11-7-17-32(40)34-27-28(25-26-41(34)45)44-39-23-12-22-38-42(39)33-18-6-10-21-37(33)43(38)35-19-8-4-15-30(35)31-16-5-9-20-36(31)43/h1-27,44H
InChIKeyXGBAQSUCXXMNAQ-UHFFFAOYSA-N
MW572.71 g/mol
LogP10.87
Rot. Bonds3

About 9-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)carbazol-3-amine

9-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)carbazol-3-amine (PubChem CID 146332882) has the molecular formula C43H28N2 and a molecular weight of 572.71 g/mol. Its IUPAC name is 9-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)carbazol-3-amine.

Molecular Properties

Compound Name9-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)carbazol-3-amine
PubChem CID146332882
Molecular FormulaC43H28N2
Molecular Weight572.71 g/mol
Exact Mass572.23
IUPAC Name9-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)carbazol-3-amine
SMILESc1ccc(-n2c3ccccc3c3cc(Nc4cccc5c4-c4ccccc4C54c5ccccc5-c5ccccc54)ccc32)cc1
InChIInChI=1S/C43H28N2/c1-2-13-29(14-3-1)45-40-24-11-7-17-32(40)34-27-28(25-26-41(34)45)44-39-23-12-22-38-42(39)33-18-6-10-21-37(33)43(38)35-19-8-4-15-30(35)31-16-5-9-20-36(31)43/h1-27,44H
InChIKeyXGBAQSUCXXMNAQ-UHFFFAOYSA-N
XLogP10.87
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500572.71
LogP ≤ 510.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

9-phenyl-N-spiro[benzo[c]fluorene-7,9'-xanthene]-11-ylcarbazol-3-amine
CID 170936096
9-phenyl-N-spiro[fluorene-9,9'-xanthene]-4-ylcarbazol-1-amine
CID 169305047
N-(9,9-dimethyl-7-naphthalen-1-ylfluoren-2-yl)-9-phenylcarbazol-3-amine;N-(4-naphthalen-1-ylnaphthalen-1-yl)-9-phenylcarbazol-3-amine;N-(5-naphthalen-1-ylnaphthalen-1-yl)-9-phenylcarbazol-3-amine;N-(6-naphthalen-1-ylnaphthalen-2-yl)-9-phenylcarbazol-3-amine;N-(7'-naphthalen-1-yl-9,9'-spirobi[fluorene]-2'-yl)-9-phenylcarbazol-3-amine
CID 158943962
N-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9'-spirobi[fluorene]-1-amine
CID 71249287
N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-4-amine
CID 90294631
9-phenyl-3-[4-[7'-[4-(9-phenylcarbazol-3-yl)phenyl]-9,9'-spirobi[fluorene]-2'-yl]phenyl]carbazole
CID 59236537
bis[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;9,9-dimethyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]fluoren-4-amine
CID 158287597
9-phenyl-3-(9-phenylcarbazol-3-yl)-6-[10-[2-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-9,9'-spirobi[fluorene]-4'-yl]triphenylen-2-yl]carbazole
CID 134440451
9-phenyl-3-[4-[4-(9,9'-spirobi[fluorene]-4'-ylmethyl)phenyl]phenyl]carbazole
CID 158819687
2-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 121360373
9-[2-(3-carbazol-9-ylphenyl)phenyl]-N-(2-phenylphenyl)carbazol-3-amine
CID 169288929
9-phenyl-3-spiro[benzo[c]fluorene-7,9'-fluorene]-2'-ylcarbazole
CID 129264521

Frequently Asked Questions

What is the IUPAC name of 9-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)carbazol-3-amine?
The IUPAC name of 9-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)carbazol-3-amine (CID 146332882) is 9-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)carbazol-3-amine.
What is the SMILES notation for 9-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)carbazol-3-amine?
The canonical SMILES for 9-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)carbazol-3-amine is c1ccc(-n2c3ccccc3c3cc(Nc4cccc5c4-c4ccccc4C54c5ccccc5-c5ccccc54)ccc32)cc1.
What is the InChIKey of 9-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)carbazol-3-amine?
The InChIKey is XGBAQSUCXXMNAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H28N2/c1-2-13-29(14-3-1)45-40-24-11-7-17-32(40)34-27-28(25-26-41(34)45)44-39-23-12-22-38-42(39)33-18-6-10-21-37(33)43(38)35-19-8-4-15-30(35)31-16-5-9-20-36(31)43/h1-27,44H.
What are the key properties of 9-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)carbazol-3-amine?
9-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)carbazol-3-amine has a molecular weight of 572.71 g/mol, XLogP of 10.87, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)carbazol-3-amine is sourced from PubChem (CID 146332882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).