9-naphthalen-1-yl-N-phenyl-N-[4-(3-phenylquinoxalin-2-yl)phenyl]carbazol-3-amine

C48H32N4 — CID 59260051

IUPAC9-naphthalen-1-yl-N-phenyl-N-[4-(3-phenylquinoxalin-2-yl)phenyl]carbazol-3-amine
SMILESc1ccc(-c2nc3ccccc3nc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)c3ccccc3n4-c3cccc4ccccc34)cc2)cc1
InChIInChI=1S/C48H32N4/c1-3-15-34(16-4-1)47-48(50-43-23-11-10-22-42(43)49-47)35-26-28-37(29-27-35)51(36-18-5-2-6-19-36)38-30-31-46-41(32-38)40-21-9-12-24-45(40)52(46)44-25-13-17-33-14-7-8-20-39(33)44/h1-32H
InChIKeyHDSOALJXVCHOSO-UHFFFAOYSA-N
MW664.81 g/mol
LogP12.68
Rot. Bonds6

About 9-naphthalen-1-yl-N-phenyl-N-[4-(3-phenylquinoxalin-2-yl)phenyl]carbazol-3-amine

9-naphthalen-1-yl-N-phenyl-N-[4-(3-phenylquinoxalin-2-yl)phenyl]carbazol-3-amine (PubChem CID 59260051) has the molecular formula C48H32N4 and a molecular weight of 664.81 g/mol. Its IUPAC name is 9-naphthalen-1-yl-N-phenyl-N-[4-(3-phenylquinoxalin-2-yl)phenyl]carbazol-3-amine.

Molecular Properties

Compound Name9-naphthalen-1-yl-N-phenyl-N-[4-(3-phenylquinoxalin-2-yl)phenyl]carbazol-3-amine
PubChem CID59260051
Molecular FormulaC48H32N4
Molecular Weight664.81 g/mol
Exact Mass664.26
IUPAC Name9-naphthalen-1-yl-N-phenyl-N-[4-(3-phenylquinoxalin-2-yl)phenyl]carbazol-3-amine
SMILESc1ccc(-c2nc3ccccc3nc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)c3ccccc3n4-c3cccc4ccccc34)cc2)cc1
InChIInChI=1S/C48H32N4/c1-3-15-34(16-4-1)47-48(50-43-23-11-10-22-42(43)49-47)35-26-28-37(29-27-35)51(36-18-5-2-6-19-36)38-30-31-46-41(32-38)40-21-9-12-24-45(40)52(46)44-25-13-17-33-14-7-8-20-39(33)44/h1-32H
InChIKeyHDSOALJXVCHOSO-UHFFFAOYSA-N
XLogP12.68
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms52
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500664.81
LogP ≤ 512.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-N-(9-naphthalen-1-ylcarbazol-3-yl)-1-N,1-N-diphenyl-3-N-[3-(N-phenylanilino)phenyl]benzene-1,3-diamine
CID 177275830
1-N,3-N,5-N-tris[9-naphthalen-1-yl-6-(4-phenylphenyl)carbazol-3-yl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine
CID 59816034
9-naphthalen-1-yl-N-[4-[3-[4-(N-(9-naphthalen-1-ylcarbazol-3-yl)anilino)phenyl]quinoxalin-2-yl]phenyl]-N-phenylcarbazol-3-amine;N-naphthalen-2-yl-N-[4-[3-[4-[naphthalen-2-yl-(9-phenylcarbazol-3-yl)amino]phenyl]quinoxalin-2-yl]phenyl]-9-phenylcarbazol-3-amine;9-phenyl-N-(2-phenylphenyl)-N-[4-[3-[4-(2-phenyl-N-(9-phenylcarbazol-3-yl)anilino)phenyl]quinoxalin-2-yl]phenyl]carbazol-3-amine;N-phenyl-9-(2-phenylphenyl)-N-[4-[3-[4-(N-[9-(2-phenylphenyl)carbazol-3-yl]anilino)phenyl]quinoxalin-2-yl]phenyl]carbazol-3-amine;N-phenyl-9-(3-phenylphenyl)-N-[4-[3-[4-(N-[9-(3-phenylphenyl)carbazol-3-yl]anilino)phenyl]quinoxalin-2-yl]phenyl]carbazol-3-amine
CID 161110608
N-[3-[2-(9-naphthalen-1-ylcarbazol-3-yl)phenyl]phenyl]-N-phenylnaphthalen-2-amine
CID 118103056
N-[4-(8-naphthalen-1-yl-3-phenylquinoxalin-2-yl)phenyl]-N,9-diphenylcarbazol-3-amine
CID 59259899
N,9-diphenyl-N-[4-[3-[4-(N-(9-phenylcarbazol-3-yl)anilino)naphthalen-1-yl]quinoxalin-2-yl]naphthalen-1-yl]carbazol-3-amine;N,9-diphenyl-N-[5-[3-[5-(N-(9-phenylcarbazol-3-yl)anilino)naphthalen-1-yl]quinoxalin-2-yl]naphthalen-1-yl]carbazol-3-amine;N,9-diphenyl-N-[4-[4-[3-[4-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]quinoxalin-2-yl]phenyl]phenyl]carbazol-3-amine
CID 158704413
4-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-N-phenyl-N-[4-(3-phenylquinoxalin-2-yl)phenyl]aniline
CID 59489369
N-[4-[5-ethyl-3-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]quinoxalin-2-yl]phenyl]-N,9-diphenylcarbazol-3-amine
CID 59259901
N-[4-[2-(9-naphthalen-1-ylcarbazol-3-yl)phenyl]phenyl]-N,2-diphenylaniline
CID 118103122
N-[4-(8-naphthalen-2-yl-3-phenylquinoxalin-2-yl)phenyl]-N,9-diphenylcarbazol-3-amine
CID 59259961
4-N-[4-[5,8-dinaphthalen-1-yl-3-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]quinoxalin-2-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine;4-N-[4-[5,8-dinaphthalen-2-yl-3-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]quinoxalin-2-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine;N,9-diphenyl-N-[4-[3-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]quinoxalin-2-yl]phenyl]carbazol-3-amine;9-phenyl-N-(4-phenylphenyl)-N-[4-[3-[4-(4-phenyl-N-(9-phenylcarbazol-3-yl)anilino)phenyl]quinoxalin-2-yl]phenyl]carbazol-3-amine
CID 158238059
N-(9,10-diphenylphenanthren-2-yl)-9-naphthalen-1-yl-N-phenylcarbazol-2-amine
CID 169062114

Frequently Asked Questions

What is the IUPAC name of 9-naphthalen-1-yl-N-phenyl-N-[4-(3-phenylquinoxalin-2-yl)phenyl]carbazol-3-amine?
The IUPAC name of 9-naphthalen-1-yl-N-phenyl-N-[4-(3-phenylquinoxalin-2-yl)phenyl]carbazol-3-amine (CID 59260051) is 9-naphthalen-1-yl-N-phenyl-N-[4-(3-phenylquinoxalin-2-yl)phenyl]carbazol-3-amine.
What is the SMILES notation for 9-naphthalen-1-yl-N-phenyl-N-[4-(3-phenylquinoxalin-2-yl)phenyl]carbazol-3-amine?
The canonical SMILES for 9-naphthalen-1-yl-N-phenyl-N-[4-(3-phenylquinoxalin-2-yl)phenyl]carbazol-3-amine is c1ccc(-c2nc3ccccc3nc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)c3ccccc3n4-c3cccc4ccccc34)cc2)cc1.
What is the InChIKey of 9-naphthalen-1-yl-N-phenyl-N-[4-(3-phenylquinoxalin-2-yl)phenyl]carbazol-3-amine?
The InChIKey is HDSOALJXVCHOSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H32N4/c1-3-15-34(16-4-1)47-48(50-43-23-11-10-22-42(43)49-47)35-26-28-37(29-27-35)51(36-18-5-2-6-19-36)38-30-31-46-41(32-38)40-21-9-12-24-45(40)52(46)44-25-13-17-33-14-7-8-20-39(33)44/h1-32H.
What are the key properties of 9-naphthalen-1-yl-N-phenyl-N-[4-(3-phenylquinoxalin-2-yl)phenyl]carbazol-3-amine?
9-naphthalen-1-yl-N-phenyl-N-[4-(3-phenylquinoxalin-2-yl)phenyl]carbazol-3-amine has a molecular weight of 664.81 g/mol, XLogP of 12.68, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-naphthalen-1-yl-N-phenyl-N-[4-(3-phenylquinoxalin-2-yl)phenyl]carbazol-3-amine is sourced from PubChem (CID 59260051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).