4-(8,9-dihydro-7H-fluoren-1-yl)-N-phenyl-2-(9-phenylcarbazol-3-yl)aniline

C43H32N2 — CID 142548205

IUPAC4-(8,9-dihydro-7H-fluoren-1-yl)-N-phenyl-2-(9-phenylcarbazol-3-yl)aniline
SMILESC1=CC2=C(CC1)Cc1c2cccc1-c1ccc(Nc2ccccc2)c(-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c1
InChIInChI=1S/C43H32N2/c1-3-13-32(14-4-1)44-41-24-22-30(35-19-11-20-36-34-17-8-7-12-29(34)27-39(35)36)26-38(41)31-23-25-43-40(28-31)37-18-9-10-21-42(37)45(43)33-15-5-2-6-16-33/h1-6,8-11,13-26,28,44H,7,12,27H2
InChIKeyPDIHBZYVYWDOND-UHFFFAOYSA-N
MW576.74 g/mol
LogP11.52
Rot. Bonds5

About 4-(8,9-dihydro-7H-fluoren-1-yl)-N-phenyl-2-(9-phenylcarbazol-3-yl)aniline

4-(8,9-dihydro-7H-fluoren-1-yl)-N-phenyl-2-(9-phenylcarbazol-3-yl)aniline (PubChem CID 142548205) has the molecular formula C43H32N2 and a molecular weight of 576.74 g/mol. Its IUPAC name is 4-(8,9-dihydro-7H-fluoren-1-yl)-N-phenyl-2-(9-phenylcarbazol-3-yl)aniline.

Molecular Properties

Compound Name4-(8,9-dihydro-7H-fluoren-1-yl)-N-phenyl-2-(9-phenylcarbazol-3-yl)aniline
PubChem CID142548205
Molecular FormulaC43H32N2
Molecular Weight576.74 g/mol
Exact Mass576.26
IUPAC Name4-(8,9-dihydro-7H-fluoren-1-yl)-N-phenyl-2-(9-phenylcarbazol-3-yl)aniline
SMILESC1=CC2=C(CC1)Cc1c2cccc1-c1ccc(Nc2ccccc2)c(-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c1
InChIInChI=1S/C43H32N2/c1-3-13-32(14-4-1)44-41-24-22-30(35-19-11-20-36-34-17-8-7-12-29(34)27-39(35)36)26-38(41)31-23-25-43-40(28-31)37-18-9-10-21-42(37)45(43)33-15-5-2-6-16-33/h1-6,8-11,13-26,28,44H,7,12,27H2
InChIKeyPDIHBZYVYWDOND-UHFFFAOYSA-N
XLogP11.52
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500576.74
LogP ≤ 511.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-N,3-N-diphenyl-4,6-bis(9-phenylcarbazol-3-yl)benzene-1,3-diamine
CID 161099965
3-[8-[3-(8,9-dihydro-7H-fluoren-3-yl)phenyl]dibenzofuran-2-yl]-9-phenylcarbazole
CID 144605224
N-phenyl-2-[3-[9-(3-phenylphenyl)carbazol-3-yl]phenyl]aniline
CID 118907859
1-N-phenyl-4-N-[4-(9-phenylcarbazol-3-yl)phenyl]-2-(4-phenylphenyl)benzene-1,4-diamine
CID 175396320
N-[2-dibenzofuran-2-yl-4-(9-phenylcarbazol-3-yl)phenyl]naphthalen-1-amine
CID 121343364
2-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 121360373
N-[4-(9H-fluoren-1-yl)phenyl]-4-(9-phenylcarbazol-3-yl)aniline
CID 155138336
3-[4-anilino-3-(3-dibenzofuran-4-ylphenyl)phenyl]-5-(9-phenylcarbazol-3-yl)benzonitrile
CID 121262064
N-phenyl-3-(9-phenylcarbazol-3-yl)aniline
CID 59827989
2-phenyl-4-(9-phenylcarbazol-2-yl)-N-(4-phenylphenyl)aniline
CID 118907856
2-naphthalen-2-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]aniline;3-naphthalen-2-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]aniline;N-(4-naphthalen-2-ylphenyl)-2-(9-phenylcarbazol-3-yl)aniline;N-(4-naphthalen-2-ylphenyl)-3-(9-phenylcarbazol-3-yl)aniline
CID 158992655
N-[2-phenyl-4-(9-phenylcarbazol-3-yl)phenyl]dibenzothiophen-2-amine
CID 126700453

Frequently Asked Questions

What is the IUPAC name of 4-(8,9-dihydro-7H-fluoren-1-yl)-N-phenyl-2-(9-phenylcarbazol-3-yl)aniline?
The IUPAC name of 4-(8,9-dihydro-7H-fluoren-1-yl)-N-phenyl-2-(9-phenylcarbazol-3-yl)aniline (CID 142548205) is 4-(8,9-dihydro-7H-fluoren-1-yl)-N-phenyl-2-(9-phenylcarbazol-3-yl)aniline.
What is the SMILES notation for 4-(8,9-dihydro-7H-fluoren-1-yl)-N-phenyl-2-(9-phenylcarbazol-3-yl)aniline?
The canonical SMILES for 4-(8,9-dihydro-7H-fluoren-1-yl)-N-phenyl-2-(9-phenylcarbazol-3-yl)aniline is C1=CC2=C(CC1)Cc1c2cccc1-c1ccc(Nc2ccccc2)c(-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c1.
What is the InChIKey of 4-(8,9-dihydro-7H-fluoren-1-yl)-N-phenyl-2-(9-phenylcarbazol-3-yl)aniline?
The InChIKey is PDIHBZYVYWDOND-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H32N2/c1-3-13-32(14-4-1)44-41-24-22-30(35-19-11-20-36-34-17-8-7-12-29(34)27-39(35)36)26-38(41)31-23-25-43-40(28-31)37-18-9-10-21-42(37)45(43)33-15-5-2-6-16-33/h1-6,8-11,13-26,28,44H,7,12,27H2.
What are the key properties of 4-(8,9-dihydro-7H-fluoren-1-yl)-N-phenyl-2-(9-phenylcarbazol-3-yl)aniline?
4-(8,9-dihydro-7H-fluoren-1-yl)-N-phenyl-2-(9-phenylcarbazol-3-yl)aniline has a molecular weight of 576.74 g/mol, XLogP of 11.52, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(8,9-dihydro-7H-fluoren-1-yl)-N-phenyl-2-(9-phenylcarbazol-3-yl)aniline is sourced from PubChem (CID 142548205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).