9-(4-fluorophenyl)-N-[4-(9-methylfluoren-9-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine

C50H35FN2 — CID 129293050

IUPAC9-(4-fluorophenyl)-N-[4-(9-methylfluoren-9-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine
SMILESCC1(c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)c3ccccc3n4-c3ccc(F)cc3)cc2)c2ccccc2-c2ccccc21
InChIInChI=1S/C50H35FN2/c1-50(46-16-8-5-13-42(46)43-14-6-9-17-47(43)50)36-21-27-39(28-22-36)52(38-25-19-35(20-26-38)34-11-3-2-4-12-34)41-31-32-49-45(33-41)44-15-7-10-18-48(44)53(49)40-29-23-37(51)24-30-40/h2-33H,1H3
InChIKeyPSRPCUWOBPDQGG-UHFFFAOYSA-N
MW682.84 g/mol
LogP13.39
Rot. Bonds6

About 9-(4-fluorophenyl)-N-[4-(9-methylfluoren-9-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine

9-(4-fluorophenyl)-N-[4-(9-methylfluoren-9-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine (PubChem CID 129293050) has the molecular formula C50H35FN2 and a molecular weight of 682.84 g/mol. Its IUPAC name is 9-(4-fluorophenyl)-N-[4-(9-methylfluoren-9-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine.

Molecular Properties

Compound Name9-(4-fluorophenyl)-N-[4-(9-methylfluoren-9-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine
PubChem CID129293050
Molecular FormulaC50H35FN2
Molecular Weight682.84 g/mol
Exact Mass682.28
IUPAC Name9-(4-fluorophenyl)-N-[4-(9-methylfluoren-9-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine
SMILESCC1(c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)c3ccccc3n4-c3ccc(F)cc3)cc2)c2ccccc2-c2ccccc21
InChIInChI=1S/C50H35FN2/c1-50(46-16-8-5-13-42(46)43-14-6-9-17-47(43)50)36-21-27-39(28-22-36)52(38-25-19-35(20-26-38)34-11-3-2-4-12-34)41-31-32-49-45(33-41)44-15-7-10-18-48(44)53(49)40-29-23-37(51)24-30-40/h2-33H,1H3
InChIKeyPSRPCUWOBPDQGG-UHFFFAOYSA-N
XLogP13.39
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms53
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500682.84
LogP ≤ 513.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9-(4-fluorophenyl)-N-[4-[4-[4-(4-fluorophenyl)-N-[9-(4-fluorophenyl)carbazol-3-yl]anilino]phenyl]phenyl]-N-[4-(4-fluorophenyl)phenyl]carbazol-3-amine
CID 59844874
9-(4-fluorophenyl)-N-(4-phenylphenyl)-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-3-amine
CID 162779812
N-[4-(9-methylfluoren-9-yl)phenyl]-N-naphthalen-2-yl-9-phenylcarbazol-3-amine
CID 129293001
9-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine
CID 129264403
3-(9-methylfluoren-9-yl)-N-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 129293023
N-[4-(9-methylfluoren-9-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]naphthalen-1-amine
CID 129293021
1-N,3-N-bis(9,9-dimethylfluoren-2-yl)-1-N,3-N-bis(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine;1-N,3-N-bis(9,9-dimethylfluoren-2-yl)-1-N,3-N-diphenyl-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine;1-N,3-N-bis(4-fluorophenyl)-1-N,3-N-diphenyl-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-diphenyl-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine;1-N,1-N,3-N,3-N-tetrakis(4-methylphenyl)-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine;1-N,1-N,3-N,3-N-tetraphenyl-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine
CID 158166939
9-(4-fluorophenyl)-N-phenyl-N-[4-[2,3,5,6-tetradeuterio-4-[2,3,5,6-tetradeuterio-4-(N-phenylanilino)phenyl]phenyl]phenyl]carbazol-3-amine
CID 163706224
N-(4-carbazol-9-ylphenyl)-N-phenyl-9-(4-phenylphenyl)carbazol-3-amine
CID 129061469
1-N,4-N-bis(4-fluorophenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine
CID 58983384
N-(9,9-diphenylfluoren-2-yl)-N-(4-fluorophenyl)-9-phenylcarbazol-3-amine;4-[(9,9-diphenylfluoren-2-yl)-(9-phenylcarbazol-3-yl)amino]benzonitrile;N-(9,9-diphenylfluoren-2-yl)-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine
CID 160678187
N-[9-[4-(4-carbazol-9-ylphenyl)phenyl]-9-phenylfluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;9-[4-(4-fluorophenyl)phenyl]-9-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;N,N,9-triphenyl-9-[4-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]phenyl]fluoren-2-amine
CID 163921069

Frequently Asked Questions

What is the IUPAC name of 9-(4-fluorophenyl)-N-[4-(9-methylfluoren-9-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine?
The IUPAC name of 9-(4-fluorophenyl)-N-[4-(9-methylfluoren-9-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine (CID 129293050) is 9-(4-fluorophenyl)-N-[4-(9-methylfluoren-9-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine.
What is the SMILES notation for 9-(4-fluorophenyl)-N-[4-(9-methylfluoren-9-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine?
The canonical SMILES for 9-(4-fluorophenyl)-N-[4-(9-methylfluoren-9-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine is CC1(c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)c3ccccc3n4-c3ccc(F)cc3)cc2)c2ccccc2-c2ccccc21.
What is the InChIKey of 9-(4-fluorophenyl)-N-[4-(9-methylfluoren-9-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine?
The InChIKey is PSRPCUWOBPDQGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H35FN2/c1-50(46-16-8-5-13-42(46)43-14-6-9-17-47(43)50)36-21-27-39(28-22-36)52(38-25-19-35(20-26-38)34-11-3-2-4-12-34)41-31-32-49-45(33-41)44-15-7-10-18-48(44)53(49)40-29-23-37(51)24-30-40/h2-33H,1H3.
What are the key properties of 9-(4-fluorophenyl)-N-[4-(9-methylfluoren-9-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine?
9-(4-fluorophenyl)-N-[4-(9-methylfluoren-9-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine has a molecular weight of 682.84 g/mol, XLogP of 13.39, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-fluorophenyl)-N-[4-(9-methylfluoren-9-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine is sourced from PubChem (CID 129293050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).