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

C48H34N2 — CID 169010333

IUPAC5,9-diphenyl-N-(2-phenylphenyl)-N-(3-phenylphenyl)carbazol-2-amine
SMILESc1ccc(-c2cccc(N(c3ccc4c5c(-c6ccccc6)cccc5n(-c5ccccc5)c4c3)c3ccccc3-c3ccccc3)c2)cc1
InChIInChI=1S/C48H34N2/c1-5-17-35(18-6-1)38-23-15-26-40(33-38)49(45-29-14-13-27-42(45)36-19-7-2-8-20-36)41-31-32-44-47(34-41)50(39-24-11-4-12-25-39)46-30-16-28-43(48(44)46)37-21-9-3-10-22-37/h1-34H
InChIKeyOEDFEQJLXRTKPQ-UHFFFAOYSA-N
MW638.81 g/mol
LogP13.25
Rot. Bonds7

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

5,9-diphenyl-N-(2-phenylphenyl)-N-(3-phenylphenyl)carbazol-2-amine (PubChem CID 169010333) 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-(3-phenylphenyl)carbazol-2-amine.

Molecular Properties

Compound Name5,9-diphenyl-N-(2-phenylphenyl)-N-(3-phenylphenyl)carbazol-2-amine
PubChem CID169010333
Molecular FormulaC48H34N2
Molecular Weight638.81 g/mol
Exact Mass638.27
IUPAC Name5,9-diphenyl-N-(2-phenylphenyl)-N-(3-phenylphenyl)carbazol-2-amine
SMILESc1ccc(-c2cccc(N(c3ccc4c5c(-c6ccccc6)cccc5n(-c5ccccc5)c4c3)c3ccccc3-c3ccccc3)c2)cc1
InChIInChI=1S/C48H34N2/c1-5-17-35(18-6-1)38-23-15-26-40(33-38)49(45-29-14-13-27-42(45)36-19-7-2-8-20-36)41-31-32-44-47(34-41)50(39-24-11-4-12-25-39)46-30-16-28-43(48(44)46)37-21-9-3-10-22-37/h1-34H
InChIKeyOEDFEQJLXRTKPQ-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

N-(6,9-diphenylcarbazol-3-yl)-5,9-diphenyl-N-(2-phenylphenyl)carbazol-2-amine
CID 169009785
5,9-diphenyl-N-[4-(9-phenylcarbazol-4-yl)phenyl]-N-(3-phenylphenyl)carbazol-2-amine
CID 169009961
N,N,5,9-tetraphenylcarbazol-2-amine
CID 155156029
N-[3-(6,9-diphenylcarbazol-4-yl)phenyl]-2-phenyl-N-(4-phenylphenyl)aniline
CID 167195810
N-naphthalen-1-yl-5,9-diphenyl-N-(4-phenylphenyl)carbazol-2-amine
CID 169009927
3-(7,9-diphenylcarbazol-4-yl)-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
CID 166659605
N,9-diphenyl-5-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-2-amine
CID 169009789
4-(5,9-diphenylcarbazol-2-yl)-N,N-diphenylaniline
CID 169010334
N-(3-dibenzothiophen-4-ylphenyl)-5,9-diphenyl-N-(2-phenylphenyl)carbazol-2-amine
CID 169010108
5,9-diphenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine
CID 169010302
N-phenyl-2-[3-(9-phenylcarbazol-4-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]aniline
CID 166659568
5,9-diphenyl-N-[3-(9-phenylfluoren-9-yl)phenyl]-N-(2-phenylphenyl)carbazol-2-amine
CID 169010409

Frequently Asked Questions

What is the IUPAC name of 5,9-diphenyl-N-(2-phenylphenyl)-N-(3-phenylphenyl)carbazol-2-amine?
The IUPAC name of 5,9-diphenyl-N-(2-phenylphenyl)-N-(3-phenylphenyl)carbazol-2-amine (CID 169010333) is 5,9-diphenyl-N-(2-phenylphenyl)-N-(3-phenylphenyl)carbazol-2-amine.
What is the SMILES notation for 5,9-diphenyl-N-(2-phenylphenyl)-N-(3-phenylphenyl)carbazol-2-amine?
The canonical SMILES for 5,9-diphenyl-N-(2-phenylphenyl)-N-(3-phenylphenyl)carbazol-2-amine is c1ccc(-c2cccc(N(c3ccc4c5c(-c6ccccc6)cccc5n(-c5ccccc5)c4c3)c3ccccc3-c3ccccc3)c2)cc1.
What is the InChIKey of 5,9-diphenyl-N-(2-phenylphenyl)-N-(3-phenylphenyl)carbazol-2-amine?
The InChIKey is OEDFEQJLXRTKPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H34N2/c1-5-17-35(18-6-1)38-23-15-26-40(33-38)49(45-29-14-13-27-42(45)36-19-7-2-8-20-36)41-31-32-44-47(34-41)50(39-24-11-4-12-25-39)46-30-16-28-43(48(44)46)37-21-9-3-10-22-37/h1-34H.
What are the key properties of 5,9-diphenyl-N-(2-phenylphenyl)-N-(3-phenylphenyl)carbazol-2-amine?
5,9-diphenyl-N-(2-phenylphenyl)-N-(3-phenylphenyl)carbazol-2-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-(3-phenylphenyl)carbazol-2-amine is sourced from PubChem (CID 169010333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).