9-(4-fluorophenyl)-N-naphthalen-2-yl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine

C49H33FN2 — CID 162779844

IUPAC9-(4-fluorophenyl)-N-naphthalen-2-yl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine
SMILESFc1ccc(-n2c3ccccc3c3ccc(N(c4ccc5c(c4)C4(Cc6ccccc6C4)c4ccccc4-5)c4ccc5ccccc5c4)cc32)cc1
InChIInChI=1S/C49H33FN2/c50-36-18-21-37(22-19-36)52-47-16-8-6-14-43(47)44-26-24-40(29-48(44)52)51(38-20-17-32-9-1-2-10-33(32)27-38)39-23-25-42-41-13-5-7-15-45(41)49(46(42)28-39)30-34-11-3-4-12-35(34)31-49/h1-29H,30-31H2
InChIKeyJYGGFDPSWGFUGT-UHFFFAOYSA-N
MW668.82 g/mol
LogP12.61
Rot. Bonds4

About 9-(4-fluorophenyl)-N-naphthalen-2-yl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine

9-(4-fluorophenyl)-N-naphthalen-2-yl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine (PubChem CID 162779844) has the molecular formula C49H33FN2 and a molecular weight of 668.82 g/mol. Its IUPAC name is 9-(4-fluorophenyl)-N-naphthalen-2-yl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine.

Molecular Properties

Compound Name9-(4-fluorophenyl)-N-naphthalen-2-yl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine
PubChem CID162779844
Molecular FormulaC49H33FN2
Molecular Weight668.82 g/mol
Exact Mass668.26
IUPAC Name9-(4-fluorophenyl)-N-naphthalen-2-yl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine
SMILESFc1ccc(-n2c3ccccc3c3ccc(N(c4ccc5c(c4)C4(Cc6ccccc6C4)c4ccccc4-5)c4ccc5ccccc5c4)cc32)cc1
InChIInChI=1S/C49H33FN2/c50-36-18-21-37(22-19-36)52-47-16-8-6-14-43(47)44-26-24-40(29-48(44)52)51(38-20-17-32-9-1-2-10-33(32)27-38)39-23-25-42-41-13-5-7-15-45(41)49(46(42)28-39)30-34-11-3-4-12-35(34)31-49/h1-29H,30-31H2
InChIKeyJYGGFDPSWGFUGT-UHFFFAOYSA-N
XLogP12.61
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms52
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500668.82
LogP ≤ 512.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9-(4-fluorophenyl)-N-(4-phenylphenyl)-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-3-amine
CID 162779812
N,9-diphenyl-N-(4-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylphenyl)carbazol-2-amine
CID 162779800
N-dibenzofuran-3-yl-9-phenyl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine
CID 162779852
N-dibenzothiophen-1-yl-9-phenyl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine;9-(4-fluorophenyl)-N-phenyl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine;N-(4-naphthalen-1-ylphenyl)-9-phenyl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine
CID 163982536
N-(4-carbazol-9-ylphenyl)-9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine
CID 58969347
N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-(4-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylphenyl)carbazol-2-amine;N-(9,9-dimethylfluoren-3-yl)-9-phenyl-N-(3-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylphenyl)carbazol-2-amine;N-(2-naphthalen-2-ylphenyl)-9-phenyl-N-(2-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylphenyl)carbazol-2-amine;N-naphthalen-2-yl-9-phenyl-N-(3-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylphenyl)carbazol-2-amine
CID 163655086
N,9-dinaphthalen-2-yl-N-spiro[benzo[a]phenalene-7,9'-fluorene]-2'-ylcarbazol-2-amine
CID 164732134
N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(3-phenylphenyl)spiro[1,3-dihydroindene-2,9'-fluorene]-2'-amine
CID 162779846
9-(4-fluorophenyl)-N-(4-heptacyclo[11.10.1.11,8.02,7.017,24.018,23.012,25]pentacosa-2(7),3,5,8,10,12(25),13,15,17(24),18,20,22-dodecaenyl)-N-phenylcarbazol-2-amine
CID 156664796
5-(9,9-dimethylfluoren-2-yl)-N-(9-phenylcarbazol-2-yl)-N-(9,9'-spirobi[fluorene]-2-yl)benzo[b]carbazol-3-amine
CID 145335035
N-(2-naphthalen-2-ylphenyl)-9-phenyl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-3'-ylcarbazol-3-amine
CID 162779873
9,9-dimethyl-N-naphthalen-2-yl-N-[3-(9-phenylcarbazol-2-yl)phenyl]fluoren-2-amine
CID 129085046

Frequently Asked Questions

What is the IUPAC name of 9-(4-fluorophenyl)-N-naphthalen-2-yl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine?
The IUPAC name of 9-(4-fluorophenyl)-N-naphthalen-2-yl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine (CID 162779844) is 9-(4-fluorophenyl)-N-naphthalen-2-yl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine.
What is the SMILES notation for 9-(4-fluorophenyl)-N-naphthalen-2-yl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine?
The canonical SMILES for 9-(4-fluorophenyl)-N-naphthalen-2-yl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine is Fc1ccc(-n2c3ccccc3c3ccc(N(c4ccc5c(c4)C4(Cc6ccccc6C4)c4ccccc4-5)c4ccc5ccccc5c4)cc32)cc1.
What is the InChIKey of 9-(4-fluorophenyl)-N-naphthalen-2-yl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine?
The InChIKey is JYGGFDPSWGFUGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H33FN2/c50-36-18-21-37(22-19-36)52-47-16-8-6-14-43(47)44-26-24-40(29-48(44)52)51(38-20-17-32-9-1-2-10-33(32)27-38)39-23-25-42-41-13-5-7-15-45(41)49(46(42)28-39)30-34-11-3-4-12-35(34)31-49/h1-29H,30-31H2.
What are the key properties of 9-(4-fluorophenyl)-N-naphthalen-2-yl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine?
9-(4-fluorophenyl)-N-naphthalen-2-yl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine has a molecular weight of 668.82 g/mol, XLogP of 12.61, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-fluorophenyl)-N-naphthalen-2-yl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine is sourced from PubChem (CID 162779844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).