N-naphthalen-1-yl-5,9-diphenyl-N-(4-phenylphenyl)carbazol-3-amine

C46H32N2 — CID 169010104

IUPACN-naphthalen-1-yl-5,9-diphenyl-N-(4-phenylphenyl)carbazol-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc4c(c3)c3c(-c5ccccc5)cccc3n4-c3ccccc3)c3cccc4ccccc34)cc2)cc1
InChIInChI=1S/C46H32N2/c1-4-14-33(15-5-1)34-26-28-38(29-27-34)47(43-24-12-19-35-18-10-11-22-40(35)43)39-30-31-44-42(32-39)46-41(36-16-6-2-7-17-36)23-13-25-45(46)48(44)37-20-8-3-9-21-37/h1-32H
InChIKeyZIAPMLMHCIZMHQ-UHFFFAOYSA-N
MW612.78 g/mol
LogP12.74
Rot. Bonds6

About N-naphthalen-1-yl-5,9-diphenyl-N-(4-phenylphenyl)carbazol-3-amine

N-naphthalen-1-yl-5,9-diphenyl-N-(4-phenylphenyl)carbazol-3-amine (PubChem CID 169010104) has the molecular formula C46H32N2 and a molecular weight of 612.78 g/mol. Its IUPAC name is N-naphthalen-1-yl-5,9-diphenyl-N-(4-phenylphenyl)carbazol-3-amine.

Molecular Properties

Compound NameN-naphthalen-1-yl-5,9-diphenyl-N-(4-phenylphenyl)carbazol-3-amine
PubChem CID169010104
Molecular FormulaC46H32N2
Molecular Weight612.78 g/mol
Exact Mass612.26
IUPAC NameN-naphthalen-1-yl-5,9-diphenyl-N-(4-phenylphenyl)carbazol-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc4c(c3)c3c(-c5ccccc5)cccc3n4-c3ccccc3)c3cccc4ccccc34)cc2)cc1
InChIInChI=1S/C46H32N2/c1-4-14-33(15-5-1)34-26-28-38(29-27-34)47(43-24-12-19-35-18-10-11-22-40(35)43)39-30-31-44-42(32-39)46-41(36-16-6-2-7-17-36)23-13-25-45(46)48(44)37-20-8-3-9-21-37/h1-32H
InChIKeyZIAPMLMHCIZMHQ-UHFFFAOYSA-N
XLogP12.74
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500612.78
LogP ≤ 512.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5,9-diphenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine
CID 169010302
N-naphthalen-1-yl-5,9-diphenyl-N-(4-phenylphenyl)carbazol-2-amine
CID 169009927
N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[3-(9-phenylcarbazol-4-yl)phenyl]naphthalen-1-amine
CID 167195242
5,9-diphenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(2-phenylphenyl)carbazol-3-amine
CID 169009793
N-[3-(9-phenylcarbazol-4-yl)phenyl]-N-[4-(3-phenylphenyl)phenyl]naphthalen-1-amine
CID 166659485
N-(4-carbazol-9-ylphenyl)-5,9-diphenyl-N-(2-phenylphenyl)carbazol-3-amine
CID 169010216
N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[3-[3-(9-phenylcarbazol-4-yl)phenyl]phenyl]naphthalen-1-amine
CID 167195982
N-[3-[3-(9-phenylcarbazol-4-yl)phenyl]phenyl]-N-[4-(2-phenylphenyl)phenyl]naphthalen-1-amine
CID 166659786
N-[4-(3,4-diphenylphenyl)phenyl]-N-[3-(9-phenylcarbazol-4-yl)phenyl]naphthalen-1-amine
CID 164832079
5,9-diphenyl-N-(9-phenylcarbazol-3-yl)-N-(2-phenylphenyl)carbazol-3-amine
CID 169010368
3-N,6-N-dinaphthalen-1-yl-3-N,6-N-bis(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole-3,6-diamine
CID 59132913
9-(4-carbazol-9-ylphenyl)-N-naphthalen-1-yl-N-(4-phenylphenyl)carbazol-3-amine
CID 158694626

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-1-yl-5,9-diphenyl-N-(4-phenylphenyl)carbazol-3-amine?
The IUPAC name of N-naphthalen-1-yl-5,9-diphenyl-N-(4-phenylphenyl)carbazol-3-amine (CID 169010104) is N-naphthalen-1-yl-5,9-diphenyl-N-(4-phenylphenyl)carbazol-3-amine.
What is the SMILES notation for N-naphthalen-1-yl-5,9-diphenyl-N-(4-phenylphenyl)carbazol-3-amine?
The canonical SMILES for N-naphthalen-1-yl-5,9-diphenyl-N-(4-phenylphenyl)carbazol-3-amine is c1ccc(-c2ccc(N(c3ccc4c(c3)c3c(-c5ccccc5)cccc3n4-c3ccccc3)c3cccc4ccccc34)cc2)cc1.
What is the InChIKey of N-naphthalen-1-yl-5,9-diphenyl-N-(4-phenylphenyl)carbazol-3-amine?
The InChIKey is ZIAPMLMHCIZMHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H32N2/c1-4-14-33(15-5-1)34-26-28-38(29-27-34)47(43-24-12-19-35-18-10-11-22-40(35)43)39-30-31-44-42(32-39)46-41(36-16-6-2-7-17-36)23-13-25-45(46)48(44)37-20-8-3-9-21-37/h1-32H.
What are the key properties of N-naphthalen-1-yl-5,9-diphenyl-N-(4-phenylphenyl)carbazol-3-amine?
N-naphthalen-1-yl-5,9-diphenyl-N-(4-phenylphenyl)carbazol-3-amine has a molecular weight of 612.78 g/mol, XLogP of 12.74, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-1-yl-5,9-diphenyl-N-(4-phenylphenyl)carbazol-3-amine is sourced from PubChem (CID 169010104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).