9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-(4-naphthalen-2-ylphenyl)-N,7-bis(4-phenylphenyl)carbazol-2-amine

C67H45N5 — CID 155409977

IUPAC9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-(4-naphthalen-2-ylphenyl)-N,7-bis(4-phenylphenyl)carbazol-2-amine
SMILESc1ccc(-c2ccc(-c3ccc4c5ccc(N(c6ccc(-c7ccccc7)cc6)c6ccc(-c7ccc8ccccc8c7)cc6)cc5n(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4c3)cc2)cc1
InChIInChI=1S/C67H45N5/c1-5-15-46(16-6-1)49-25-27-51(28-26-49)57-35-41-61-62-42-40-60(45-64(62)72(63(61)44-57)67-69-65(53-20-9-3-10-21-53)68-66(70-67)54-22-11-4-12-23-54)71(58-36-31-50(32-37-58)47-17-7-2-8-18-47)59-38-33-52(34-39-59)56-30-29-48-19-13-14-24-55(48)43-56/h1-45H
InChIKeyWPOOSVZIJCHQMJ-UHFFFAOYSA-N
MW920.13 g/mol
LogP17.59
Rot. Bonds10

About 9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-(4-naphthalen-2-ylphenyl)-N,7-bis(4-phenylphenyl)carbazol-2-amine

9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-(4-naphthalen-2-ylphenyl)-N,7-bis(4-phenylphenyl)carbazol-2-amine (PubChem CID 155409977) has the molecular formula C67H45N5 and a molecular weight of 920.13 g/mol. Its IUPAC name is 9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-(4-naphthalen-2-ylphenyl)-N,7-bis(4-phenylphenyl)carbazol-2-amine.

Molecular Properties

Compound Name9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-(4-naphthalen-2-ylphenyl)-N,7-bis(4-phenylphenyl)carbazol-2-amine
PubChem CID155409977
Molecular FormulaC67H45N5
Molecular Weight920.13 g/mol
Exact Mass919.37
IUPAC Name9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-(4-naphthalen-2-ylphenyl)-N,7-bis(4-phenylphenyl)carbazol-2-amine
SMILESc1ccc(-c2ccc(-c3ccc4c5ccc(N(c6ccc(-c7ccccc7)cc6)c6ccc(-c7ccc8ccccc8c7)cc6)cc5n(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4c3)cc2)cc1
InChIInChI=1S/C67H45N5/c1-5-15-46(16-6-1)49-25-27-51(28-26-49)57-35-41-61-62-42-40-60(45-64(62)72(63(61)44-57)67-69-65(53-20-9-3-10-21-53)68-66(70-67)54-22-11-4-12-23-54)71(58-36-31-50(32-37-58)47-17-7-2-8-18-47)59-38-33-52(34-39-59)56-30-29-48-19-13-14-24-55(48)43-56/h1-45H
InChIKeyWPOOSVZIJCHQMJ-UHFFFAOYSA-N
XLogP17.59
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms72
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500920.13
LogP ≤ 517.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-2-yl]phenyl]-N-phenylnaphthalen-2-amine
CID 164807780
N-dibenzofuran-3-yl-9-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-(4-naphthalen-2-ylphenyl)-N-phenylcarbazol-2-amine
CID 155409935
N-dibenzofuran-3-yl-9-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-phenyl-N-(4-phenylphenyl)carbazol-2-amine
CID 155410982
7-naphthalen-2-yl-N,N,9-triphenylcarbazol-2-amine
CID 146573850
9-naphthalen-1-yl-N-(4-naphthalen-2-ylphenyl)-N,7-diphenylcarbazol-2-amine
CID 146573551
4-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)phenanthren-2-yl]-N,N-diphenylaniline
CID 145009490
12-[4-(4-naphthalen-2-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene
CID 166916791
N,N-bis[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6-phenanthren-2-ylnaphthalen-2-amine
CID 164939243
9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-diphenylcarbazole
CID 126580254
3-[4,6-bis[3-(N-[4-(9-phenylcarbazol-2-yl)phenyl]anilino)phenyl]-1,3,5-triazin-2-yl]-N-phenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]aniline
CID 126631662
9-[4-(3,5-diphenylphenyl)-6-(3-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(3,5-diphenylphenyl)-6-(4-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(3-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]carbazole
CID 160984950
N,N,7,9-tetranaphthalen-2-ylcarbazol-2-amine
CID 146573842

Frequently Asked Questions

What is the IUPAC name of 9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-(4-naphthalen-2-ylphenyl)-N,7-bis(4-phenylphenyl)carbazol-2-amine?
The IUPAC name of 9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-(4-naphthalen-2-ylphenyl)-N,7-bis(4-phenylphenyl)carbazol-2-amine (CID 155409977) is 9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-(4-naphthalen-2-ylphenyl)-N,7-bis(4-phenylphenyl)carbazol-2-amine.
What is the SMILES notation for 9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-(4-naphthalen-2-ylphenyl)-N,7-bis(4-phenylphenyl)carbazol-2-amine?
The canonical SMILES for 9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-(4-naphthalen-2-ylphenyl)-N,7-bis(4-phenylphenyl)carbazol-2-amine is c1ccc(-c2ccc(-c3ccc4c5ccc(N(c6ccc(-c7ccccc7)cc6)c6ccc(-c7ccc8ccccc8c7)cc6)cc5n(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4c3)cc2)cc1.
What is the InChIKey of 9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-(4-naphthalen-2-ylphenyl)-N,7-bis(4-phenylphenyl)carbazol-2-amine?
The InChIKey is WPOOSVZIJCHQMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C67H45N5/c1-5-15-46(16-6-1)49-25-27-51(28-26-49)57-35-41-61-62-42-40-60(45-64(62)72(63(61)44-57)67-69-65(53-20-9-3-10-21-53)68-66(70-67)54-22-11-4-12-23-54)71(58-36-31-50(32-37-58)47-17-7-2-8-18-47)59-38-33-52(34-39-59)56-30-29-48-19-13-14-24-55(48)43-56/h1-45H.
What are the key properties of 9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-(4-naphthalen-2-ylphenyl)-N,7-bis(4-phenylphenyl)carbazol-2-amine?
9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-(4-naphthalen-2-ylphenyl)-N,7-bis(4-phenylphenyl)carbazol-2-amine has a molecular weight of 920.13 g/mol, XLogP of 17.59, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4,6-diphenyl-1,3,5-triazin-2-yl)-N-(4-naphthalen-2-ylphenyl)-N,7-bis(4-phenylphenyl)carbazol-2-amine is sourced from PubChem (CID 155409977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).