5,9-diphenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine

C48H34N2 — CID 169010302

IUPAC5,9-diphenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc4c(c3)c3c(-c5ccccc5)cccc3n4-c3ccccc3)c3ccccc3-c3ccccc3)cc2)cc1
InChIInChI=1S/C48H34N2/c1-5-16-35(17-6-1)36-28-30-40(31-29-36)49(45-26-14-13-24-42(45)37-18-7-2-8-19-37)41-32-33-46-44(34-41)48-43(38-20-9-3-10-21-38)25-15-27-47(48)50(46)39-22-11-4-12-23-39/h1-34H
InChIKeyJSOQCYKLNMZIHA-UHFFFAOYSA-N
MW638.81 g/mol
LogP13.25
Rot. Bonds7

About 5,9-diphenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine

5,9-diphenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine (PubChem CID 169010302) has the molecular formula C48H34N2 and a molecular weight of 638.81 g/mol. Its IUPAC name is 5,9-diphenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine.

Molecular Properties

Compound Name5,9-diphenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine
PubChem CID169010302
Molecular FormulaC48H34N2
Molecular Weight638.81 g/mol
Exact Mass638.27
IUPAC Name5,9-diphenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc4c(c3)c3c(-c5ccccc5)cccc3n4-c3ccccc3)c3ccccc3-c3ccccc3)cc2)cc1
InChIInChI=1S/C48H34N2/c1-5-16-35(17-6-1)36-28-30-40(31-29-36)49(45-26-14-13-24-42(45)37-18-7-2-8-19-37)41-32-33-46-44(34-41)48-43(38-20-9-3-10-21-38)25-15-27-47(48)50(46)39-22-11-4-12-23-39/h1-34H
InChIKeyJSOQCYKLNMZIHA-UHFFFAOYSA-N
XLogP13.25
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500638.81
LogP ≤ 513.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5,9-diphenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(2-phenylphenyl)carbazol-3-amine
CID 169009793
N-(4-carbazol-9-ylphenyl)-5,9-diphenyl-N-(2-phenylphenyl)carbazol-3-amine
CID 169010216
N-[3-(6,9-diphenylcarbazol-4-yl)phenyl]-2-phenyl-N-(4-phenylphenyl)aniline
CID 167195810
5,9-diphenyl-N-(9-phenylcarbazol-3-yl)-N-(2-phenylphenyl)carbazol-3-amine
CID 169010368
N-naphthalen-1-yl-5,9-diphenyl-N-(4-phenylphenyl)carbazol-3-amine
CID 169010104
9-phenyl-N-(2-phenylphenyl)-N-[4-[4-(2-phenyl-N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]carbazol-3-amine
CID 167019949
N-(6,9-diphenylcarbazol-3-yl)-5,9-diphenyl-N-(2-phenylphenyl)carbazol-2-amine
CID 169009785
5,9-diphenyl-N-(3-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine
CID 169009894
N-phenyl-2-[3-(9-phenylcarbazol-4-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]aniline
CID 166659568
7-phenyl-N-(2-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]benzo[c]carbazol-2-amine
CID 155034262
N-(3-carbazol-9-ylphenyl)-5,9-diphenyl-N-(4-phenylphenyl)carbazol-3-amine
CID 169010115
5,9-diphenyl-N-(9-phenylcarbazol-2-yl)-N-(4-phenylphenyl)carbazol-3-amine
CID 169009943

Frequently Asked Questions

What is the IUPAC name of 5,9-diphenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine?
The IUPAC name of 5,9-diphenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine (CID 169010302) is 5,9-diphenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine.
What is the SMILES notation for 5,9-diphenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine?
The canonical SMILES for 5,9-diphenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine is c1ccc(-c2ccc(N(c3ccc4c(c3)c3c(-c5ccccc5)cccc3n4-c3ccccc3)c3ccccc3-c3ccccc3)cc2)cc1.
What is the InChIKey of 5,9-diphenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine?
The InChIKey is JSOQCYKLNMZIHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H34N2/c1-5-16-35(17-6-1)36-28-30-40(31-29-36)49(45-26-14-13-24-42(45)37-18-7-2-8-19-37)41-32-33-46-44(34-41)48-43(38-20-9-3-10-21-38)25-15-27-47(48)50(46)39-22-11-4-12-23-39/h1-34H.
What are the key properties of 5,9-diphenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine?
5,9-diphenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine has a molecular weight of 638.81 g/mol, XLogP of 13.25, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,9-diphenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine is sourced from PubChem (CID 169010302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).