N-[4-(7-benzo[c]carbazol-7-ylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine

C54H36N2 — CID 170363151

IUPACN-[4-(7-benzo[c]carbazol-7-ylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccc5ccc(-n6c7ccccc7c7c8ccccc8ccc76)cc5c4)cc3)c3ccc4ccccc4c3)cc2)cc1
InChIInChI=1S/C54H36N2/c1-2-10-37(11-3-1)39-20-27-46(28-21-39)55(48-31-24-38-12-4-5-14-43(38)35-48)47-29-22-40(23-30-47)44-19-18-41-25-32-49(36-45(41)34-44)56-52-17-9-8-16-51(52)54-50-15-7-6-13-42(50)26-33-53(54)56/h1-36H
InChIKeyLRKFKBWIJMEUPT-UHFFFAOYSA-N
MW712.90 g/mol
LogP15.05
Rot. Bonds6

About N-[4-(7-benzo[c]carbazol-7-ylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine

N-[4-(7-benzo[c]carbazol-7-ylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine (PubChem CID 170363151) has the molecular formula C54H36N2 and a molecular weight of 712.90 g/mol. Its IUPAC name is N-[4-(7-benzo[c]carbazol-7-ylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine.

Molecular Properties

Compound NameN-[4-(7-benzo[c]carbazol-7-ylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine
PubChem CID170363151
Molecular FormulaC54H36N2
Molecular Weight712.90 g/mol
Exact Mass712.29
IUPAC NameN-[4-(7-benzo[c]carbazol-7-ylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccc5ccc(-n6c7ccccc7c7c8ccccc8ccc76)cc5c4)cc3)c3ccc4ccccc4c3)cc2)cc1
InChIInChI=1S/C54H36N2/c1-2-10-37(11-3-1)39-20-27-46(28-21-39)55(48-31-24-38-12-4-5-14-43(38)35-48)47-29-22-40(23-30-47)44-19-18-41-25-32-49(36-45(41)34-44)56-52-17-9-8-16-51(52)54-50-15-7-6-13-42(50)26-33-53(54)56/h1-36H
InChIKeyLRKFKBWIJMEUPT-UHFFFAOYSA-N
XLogP15.05
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500712.90
LogP ≤ 515.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-benzo[c]carbazol-7-ylphenyl)-3-naphthalen-2-yl-N-phenylaniline
CID 138468062
N-(7-benzo[c]carbazol-7-ylnaphthalen-2-yl)-4-phenyl-N-(4-phenylphenyl)naphthalen-2-amine
CID 167038100
N-(4-benzo[c]carbazol-7-ylphenyl)-4-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)aniline;N-(4-benzo[c]carbazol-7-ylphenyl)-4-phenyl-N-(4-phenylphenyl)aniline;4-naphthalen-2-yl-N-phenyl-N-[4-(9-phenylbenzo[c]carbazol-7-yl)phenyl]aniline
CID 159709089
N-[4-(4-benzo[c]carbazol-7-ylphenyl)phenyl]-3-phenyl-N-(4-phenylphenyl)aniline
CID 167038041
7-naphthalen-2-yl-N,N-diphenylbenzo[c]carbazol-3-amine
CID 155034728
N-[4-(6-carbazol-9-ylnaphthalen-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 142727938
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-(4-naphthalen-2-ylphenyl)-4-(4-phenylphenyl)aniline
CID 146579381
7-(5-naphthalen-2-ylindolo[3,2-c]carbazol-12-yl)-N-phenyl-N-(3-phenylphenyl)naphthalen-2-amine
CID 145273382
N-(4-naphthalen-2-ylphenyl)-6-(9-phenylcarbazol-3-yl)-N-(4-phenylphenyl)naphthalen-2-amine
CID 166956432
3,6-bis[4-(4-carbazol-9-ylphenyl)phenyl]-9-naphthalen-2-ylcarbazole;N,N-diphenyl-4-[4-[6-[4-[4-(N-phenylanilino)phenyl]phenyl]-9-(4-phenylphenyl)carbazol-3-yl]phenyl]aniline
CID 159344155
N-phenyl-N-[4-[4-(10-phenylbenzo[c]carbazol-7-yl)phenyl]phenyl]-4-(4-phenylphenyl)aniline
CID 90296031
N-(4-carbazol-9-ylphenyl)-4-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)aniline;N-(4-carbazol-9-ylphenyl)-4-naphthalen-2-yl-N-phenylaniline;N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-4-phenylaniline
CID 165047575

Frequently Asked Questions

What is the IUPAC name of N-[4-(7-benzo[c]carbazol-7-ylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine?
The IUPAC name of N-[4-(7-benzo[c]carbazol-7-ylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine (CID 170363151) is N-[4-(7-benzo[c]carbazol-7-ylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine.
What is the SMILES notation for N-[4-(7-benzo[c]carbazol-7-ylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine?
The canonical SMILES for N-[4-(7-benzo[c]carbazol-7-ylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine is c1ccc(-c2ccc(N(c3ccc(-c4ccc5ccc(-n6c7ccccc7c7c8ccccc8ccc76)cc5c4)cc3)c3ccc4ccccc4c3)cc2)cc1.
What is the InChIKey of N-[4-(7-benzo[c]carbazol-7-ylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine?
The InChIKey is LRKFKBWIJMEUPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H36N2/c1-2-10-37(11-3-1)39-20-27-46(28-21-39)55(48-31-24-38-12-4-5-14-43(38)35-48)47-29-22-40(23-30-47)44-19-18-41-25-32-49(36-45(41)34-44)56-52-17-9-8-16-51(52)54-50-15-7-6-13-42(50)26-33-53(54)56/h1-36H.
What are the key properties of N-[4-(7-benzo[c]carbazol-7-ylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine?
N-[4-(7-benzo[c]carbazol-7-ylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine has a molecular weight of 712.90 g/mol, XLogP of 15.05, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(7-benzo[c]carbazol-7-ylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine is sourced from PubChem (CID 170363151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).