9-phenyl-N-[3-(8-phenylnaphthalen-1-yl)phenyl]carbazol-2-amine

C40H28N2 — CID 169028754

IUPAC9-phenyl-N-[3-(8-phenylnaphthalen-1-yl)phenyl]carbazol-2-amine
SMILESc1ccc(-c2cccc3cccc(-c4cccc(Nc5ccc6c7ccccc7n(-c7ccccc7)c6c5)c4)c23)cc1
InChIInChI=1S/C40H28N2/c1-3-12-28(13-4-1)34-21-10-14-29-15-11-22-35(40(29)34)30-16-9-17-31(26-30)41-32-24-25-37-36-20-7-8-23-38(36)42(39(37)27-32)33-18-5-2-6-19-33/h1-27,41H
InChIKeyDGRXILMZVNBFRY-UHFFFAOYSA-N
MW536.68 g/mol
LogP11.01
Rot. Bonds5

About 9-phenyl-N-[3-(8-phenylnaphthalen-1-yl)phenyl]carbazol-2-amine

9-phenyl-N-[3-(8-phenylnaphthalen-1-yl)phenyl]carbazol-2-amine (PubChem CID 169028754) has the molecular formula C40H28N2 and a molecular weight of 536.68 g/mol. Its IUPAC name is 9-phenyl-N-[3-(8-phenylnaphthalen-1-yl)phenyl]carbazol-2-amine.

Molecular Properties

Compound Name9-phenyl-N-[3-(8-phenylnaphthalen-1-yl)phenyl]carbazol-2-amine
PubChem CID169028754
Molecular FormulaC40H28N2
Molecular Weight536.68 g/mol
Exact Mass536.23
IUPAC Name9-phenyl-N-[3-(8-phenylnaphthalen-1-yl)phenyl]carbazol-2-amine
SMILESc1ccc(-c2cccc3cccc(-c4cccc(Nc5ccc6c7ccccc7n(-c7ccccc7)c6c5)c4)c23)cc1
InChIInChI=1S/C40H28N2/c1-3-12-28(13-4-1)34-21-10-14-29-15-11-22-35(40(29)34)30-16-9-17-31(26-30)41-32-24-25-37-36-20-7-8-23-38(36)42(39(37)27-32)33-18-5-2-6-19-33/h1-27,41H
InChIKeyDGRXILMZVNBFRY-UHFFFAOYSA-N
XLogP11.01
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500536.68
LogP ≤ 511.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-carbazol-9-ylphenyl)-4-(8-phenylnaphthalen-1-yl)aniline
CID 169285498
N-[3-(9-phenylcarbazol-4-yl)phenyl]naphthalen-2-amine
CID 146293944
9-phenyl-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine
CID 142745530
N-(4-naphthalen-2-ylnaphthalen-1-yl)-9-phenylcarbazol-2-amine
CID 166997506
N-phenyl-9-(4-phenylphenyl)carbazol-2-amine;9-phenyl-N-(4-phenylphenyl)carbazol-3-amine;9-phenyl-N-[9-(4-phenylphenyl)carbazol-2-yl]carbazol-2-amine
CID 159366258
4-(4-naphthalen-1-ylphenyl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 59282038
2-(8-methylnaphthalen-1-yl)-9-phenylcarbazole
CID 170093624
N-phenyl-3-(9-phenylcarbazol-3-yl)aniline
CID 59827989
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-[3-[4-(3-anilinophenyl)phenyl]phenyl]-9-phenyl-N-(3-phenylnaphthalen-2-yl)carbazol-2-amine
CID 177098641
N,4-diphenyl-N-[4-[8-(9-phenylcarbazol-3-yl)naphthalen-1-yl]phenyl]aniline
CID 169016056
4-[9-[4-(3,5-diphenylphenyl)phenyl]carbazol-2-yl]-9-phenylcarbazole
CID 118231228

Frequently Asked Questions

What is the IUPAC name of 9-phenyl-N-[3-(8-phenylnaphthalen-1-yl)phenyl]carbazol-2-amine?
The IUPAC name of 9-phenyl-N-[3-(8-phenylnaphthalen-1-yl)phenyl]carbazol-2-amine (CID 169028754) is 9-phenyl-N-[3-(8-phenylnaphthalen-1-yl)phenyl]carbazol-2-amine.
What is the SMILES notation for 9-phenyl-N-[3-(8-phenylnaphthalen-1-yl)phenyl]carbazol-2-amine?
The canonical SMILES for 9-phenyl-N-[3-(8-phenylnaphthalen-1-yl)phenyl]carbazol-2-amine is c1ccc(-c2cccc3cccc(-c4cccc(Nc5ccc6c7ccccc7n(-c7ccccc7)c6c5)c4)c23)cc1.
What is the InChIKey of 9-phenyl-N-[3-(8-phenylnaphthalen-1-yl)phenyl]carbazol-2-amine?
The InChIKey is DGRXILMZVNBFRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H28N2/c1-3-12-28(13-4-1)34-21-10-14-29-15-11-22-35(40(29)34)30-16-9-17-31(26-30)41-32-24-25-37-36-20-7-8-23-38(36)42(39(37)27-32)33-18-5-2-6-19-33/h1-27,41H.
What are the key properties of 9-phenyl-N-[3-(8-phenylnaphthalen-1-yl)phenyl]carbazol-2-amine?
9-phenyl-N-[3-(8-phenylnaphthalen-1-yl)phenyl]carbazol-2-amine has a molecular weight of 536.68 g/mol, XLogP of 11.01, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-phenyl-N-[3-(8-phenylnaphthalen-1-yl)phenyl]carbazol-2-amine is sourced from PubChem (CID 169028754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).