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

C48H34N2 — CID 169009789

IUPACN,9-diphenyl-5-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-2-amine
SMILESc1ccc(-c2ccc(N(c3ccccc3)c3ccc4c5c(-c6cccc(-c7ccccc7)c6)cccc5n(-c5ccccc5)c4c3)cc2)cc1
InChIInChI=1S/C48H34N2/c1-5-15-35(16-6-1)37-27-29-42(30-28-37)49(40-21-9-3-10-22-40)43-31-32-45-47(34-43)50(41-23-11-4-12-24-41)46-26-14-25-44(48(45)46)39-20-13-19-38(33-39)36-17-7-2-8-18-36/h1-34H
InChIKeyREFSPQLSXINMLW-UHFFFAOYSA-N
MW638.81 g/mol
LogP13.25
Rot. Bonds7

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

N,9-diphenyl-5-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-2-amine (PubChem CID 169009789) has the molecular formula C48H34N2 and a molecular weight of 638.81 g/mol. Its IUPAC name is N,9-diphenyl-5-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-2-amine.

Molecular Properties

Compound NameN,9-diphenyl-5-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-2-amine
PubChem CID169009789
Molecular FormulaC48H34N2
Molecular Weight638.81 g/mol
Exact Mass638.27
IUPAC NameN,9-diphenyl-5-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-2-amine
SMILESc1ccc(-c2ccc(N(c3ccccc3)c3ccc4c5c(-c6cccc(-c7ccccc7)c6)cccc5n(-c5ccccc5)c4c3)cc2)cc1
InChIInChI=1S/C48H34N2/c1-5-15-35(16-6-1)37-27-29-42(30-28-37)49(40-21-9-3-10-22-40)43-31-32-45-47(34-43)50(41-23-11-4-12-24-41)46-26-14-25-44(48(45)46)39-20-13-19-38(33-39)36-17-7-2-8-18-36/h1-34H
InChIKeyREFSPQLSXINMLW-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

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

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Related Compounds

3-(7,9-diphenylcarbazol-4-yl)-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
CID 166659605
5,9-diphenyl-N-[4-(9-phenylcarbazol-4-yl)phenyl]-N-(3-phenylphenyl)carbazol-2-amine
CID 169009961
3-phenyl-N-[3-[3-(9-phenylcarbazol-4-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline
CID 166660552
3-[3-(9-phenylcarbazol-4-yl)phenyl]-N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]aniline
CID 166660208
3-[3-(9-phenylcarbazol-4-yl)phenyl]-N,N-bis[4-(4-phenylphenyl)phenyl]aniline
CID 167196004
4-(5,9-diphenylcarbazol-2-yl)-N,N-diphenylaniline
CID 169010334
N,N,5,9-tetraphenylcarbazol-2-amine
CID 155156029
5-naphthalen-2-yl-N,9-diphenyl-N-(3-phenylphenyl)carbazol-2-amine
CID 169009775
5-naphthalen-2-yl-9-phenyl-N-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-2-amine
CID 169010271
5-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)-9-phenyl-N-(4-phenylphenyl)carbazol-2-amine
CID 169010262
N-[4-(3,5-diphenylphenyl)phenyl]-3,5-diphenyl-N-[3-[3-(9-phenylcarbazol-4-yl)phenyl]phenyl]aniline
CID 167195663
N-(4-carbazol-9-ylphenyl)-9-phenyl-N-[3-(9-phenylcarbazol-4-yl)phenyl]carbazol-2-amine
CID 170286553

Frequently Asked Questions

What is the IUPAC name of N,9-diphenyl-5-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-2-amine?
The IUPAC name of N,9-diphenyl-5-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-2-amine (CID 169009789) is N,9-diphenyl-5-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-2-amine.
What is the SMILES notation for N,9-diphenyl-5-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-2-amine?
The canonical SMILES for N,9-diphenyl-5-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-2-amine is c1ccc(-c2ccc(N(c3ccccc3)c3ccc4c5c(-c6cccc(-c7ccccc7)c6)cccc5n(-c5ccccc5)c4c3)cc2)cc1.
What is the InChIKey of N,9-diphenyl-5-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-2-amine?
The InChIKey is REFSPQLSXINMLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H34N2/c1-5-15-35(16-6-1)37-27-29-42(30-28-37)49(40-21-9-3-10-22-40)43-31-32-45-47(34-43)50(41-23-11-4-12-24-41)46-26-14-25-44(48(45)46)39-20-13-19-38(33-39)36-17-7-2-8-18-36/h1-34H.
What are the key properties of N,9-diphenyl-5-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-2-amine?
N,9-diphenyl-5-(3-phenylphenyl)-N-(4-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 N,9-diphenyl-5-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-2-amine is sourced from PubChem (CID 169009789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).