4-carbazol-9-yl-N,2-diphenylaniline

C30H22N2 — CID 121360313

IUPAC4-carbazol-9-yl-N,2-diphenylaniline
SMILESc1ccc(Nc2ccc(-n3c4ccccc4c4ccccc43)cc2-c2ccccc2)cc1
InChIInChI=1S/C30H22N2/c1-3-11-22(12-4-1)27-21-24(19-20-28(27)31-23-13-5-2-6-14-23)32-29-17-9-7-15-25(29)26-16-8-10-18-30(26)32/h1-21,31H
InChIKeyOEPVFBFOGLTBJC-UHFFFAOYSA-N
MW410.52 g/mol
LogP8.19
Rot. Bonds4

About 4-carbazol-9-yl-N,2-diphenylaniline

4-carbazol-9-yl-N,2-diphenylaniline (PubChem CID 121360313) has the molecular formula C30H22N2 and a molecular weight of 410.52 g/mol. Its IUPAC name is 4-carbazol-9-yl-N,2-diphenylaniline.

Molecular Properties

Compound Name4-carbazol-9-yl-N,2-diphenylaniline
PubChem CID121360313
Molecular FormulaC30H22N2
Molecular Weight410.52 g/mol
Exact Mass410.18
IUPAC Name4-carbazol-9-yl-N,2-diphenylaniline
SMILESc1ccc(Nc2ccc(-n3c4ccccc4c4ccccc43)cc2-c2ccccc2)cc1
InChIInChI=1S/C30H22N2/c1-3-11-22(12-4-1)27-21-24(19-20-28(27)31-23-13-5-2-6-14-23)32-29-17-9-7-15-25(29)26-16-8-10-18-30(26)32/h1-21,31H
InChIKeyOEPVFBFOGLTBJC-UHFFFAOYSA-N
XLogP8.19
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500410.52
LogP ≤ 58.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-carbazol-9-ylphenyl)-2-phenylaniline
CID 70950994
9-(4-methylphenyl)-N,3-diphenylcarbazol-2-amine
CID 129125677
2-phenyl-4-(9-phenylcarbazol-2-yl)-N-(4-phenylphenyl)aniline
CID 118907856
1-N-phenyl-4-N-[4-(9-phenylcarbazol-3-yl)phenyl]-2-(4-phenylphenyl)benzene-1,4-diamine
CID 175396320
N-(3,5-diphenylphenyl)-2-phenyl-4-[9-(4-phenylphenyl)carbazol-2-yl]aniline
CID 163918921
1-N,3-N-diphenyl-4,6-bis(9-phenylcarbazol-3-yl)benzene-1,3-diamine
CID 161099965
N-phenyl-2-[3-[9-(3-phenylphenyl)carbazol-3-yl]phenyl]aniline
CID 118907859
N-[4-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]-4-phenylaniline
CID 134380568
N-(3,5-diphenylphenyl)-2-phenyl-5-(9-phenylcarbazol-2-yl)aniline;N-(3,5-diphenylphenyl)-2-phenyl-4-[9-(3-phenylphenyl)carbazol-2-yl]aniline;N-(3,5-diphenylphenyl)-2-phenyl-5-[9-(4-phenylphenyl)carbazol-2-yl]aniline
CID 163765260
2-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 121360373
5-carbazol-9-yl-2-(9-phenylcarbazol-3-yl)-N-(4-phenylphenyl)aniline
CID 163631547
5-(9-dibenzofuran-2-ylcarbazol-3-yl)-N,2-diphenylaniline
CID 118534077

Frequently Asked Questions

What is the IUPAC name of 4-carbazol-9-yl-N,2-diphenylaniline?
The IUPAC name of 4-carbazol-9-yl-N,2-diphenylaniline (CID 121360313) is 4-carbazol-9-yl-N,2-diphenylaniline.
What is the SMILES notation for 4-carbazol-9-yl-N,2-diphenylaniline?
The canonical SMILES for 4-carbazol-9-yl-N,2-diphenylaniline is c1ccc(Nc2ccc(-n3c4ccccc4c4ccccc43)cc2-c2ccccc2)cc1.
What is the InChIKey of 4-carbazol-9-yl-N,2-diphenylaniline?
The InChIKey is OEPVFBFOGLTBJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H22N2/c1-3-11-22(12-4-1)27-21-24(19-20-28(27)31-23-13-5-2-6-14-23)32-29-17-9-7-15-25(29)26-16-8-10-18-30(26)32/h1-21,31H.
What are the key properties of 4-carbazol-9-yl-N,2-diphenylaniline?
4-carbazol-9-yl-N,2-diphenylaniline has a molecular weight of 410.52 g/mol, XLogP of 8.19, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-carbazol-9-yl-N,2-diphenylaniline is sourced from PubChem (CID 121360313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).