9-(4-naphthalen-1-ylphenyl)-3-(4-naphthalen-2-ylphenyl)-6-phenylcarbazole

C50H33N — CID 177074708

IUPAC9-(4-naphthalen-1-ylphenyl)-3-(4-naphthalen-2-ylphenyl)-6-phenylcarbazole
SMILESc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(-c5ccc6ccccc6c5)cc4)ccc2n3-c2ccc(-c3cccc4ccccc34)cc2)cc1
InChIInChI=1S/C50H33N/c1-2-9-34(10-3-1)42-25-29-49-47(32-42)48-33-43(37-19-17-36(18-20-37)41-22-21-35-11-4-5-13-40(35)31-41)26-30-50(48)51(49)44-27-23-39(24-28-44)46-16-8-14-38-12-6-7-15-45(38)46/h1-33H
InChIKeyQFJJHLQJCNFXSB-UHFFFAOYSA-N
MW647.82 g/mol
LogP13.76
Rot. Bonds5

About 9-(4-naphthalen-1-ylphenyl)-3-(4-naphthalen-2-ylphenyl)-6-phenylcarbazole

9-(4-naphthalen-1-ylphenyl)-3-(4-naphthalen-2-ylphenyl)-6-phenylcarbazole (PubChem CID 177074708) has the molecular formula C50H33N and a molecular weight of 647.82 g/mol. Its IUPAC name is 9-(4-naphthalen-1-ylphenyl)-3-(4-naphthalen-2-ylphenyl)-6-phenylcarbazole.

Molecular Properties

Compound Name9-(4-naphthalen-1-ylphenyl)-3-(4-naphthalen-2-ylphenyl)-6-phenylcarbazole
PubChem CID177074708
Molecular FormulaC50H33N
Molecular Weight647.82 g/mol
Exact Mass647.26
IUPAC Name9-(4-naphthalen-1-ylphenyl)-3-(4-naphthalen-2-ylphenyl)-6-phenylcarbazole
SMILESc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(-c5ccc6ccccc6c5)cc4)ccc2n3-c2ccc(-c3cccc4ccccc34)cc2)cc1
InChIInChI=1S/C50H33N/c1-2-9-34(10-3-1)42-25-29-49-47(32-42)48-33-43(37-19-17-36(18-20-37)41-22-21-35-11-4-5-13-40(35)31-41)26-30-50(48)51(49)44-27-23-39(24-28-44)46-16-8-14-38-12-6-7-15-45(38)46/h1-33H
InChIKeyQFJJHLQJCNFXSB-UHFFFAOYSA-N
XLogP13.76
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500647.82
LogP ≤ 513.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-[9-(4-naphthalen-1-ylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 158169511
9-(4-naphthalen-1-ylphenyl)-3-(4-naphthalen-2-ylphenyl)carbazole
CID 177074694
9-[4-(6-naphthalen-1-ylnaphthalen-2-yl)phenyl]-3-(4-naphthalen-1-ylphenyl)carbazole
CID 177074752
3,6-dinaphthalen-1-yl-9-[4-[9-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-yl]phenyl]carbazole;3,6-dinaphthalen-2-yl-9-[4-[9-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-yl]phenyl]carbazole;9-[4-[9-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-yl]phenyl]-3,6-bis(2-phenylphenyl)carbazole
CID 161091193
3,9-bis(4-naphthalen-1-ylphenyl)carbazole;3-(4-naphthalen-1-ylphenyl)-9-(3-phenylphenyl)carbazole
CID 157309871
6-[9-(6-naphthalen-1-ylnaphthalen-2-yl)carbazol-3-yl]-2-[9-(6-naphthalen-2-ylnaphthalen-2-yl)-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]-9-phenylcarbazole
CID 137420566
N-(4-carbazol-9-ylphenyl)-4-naphthalen-2-yl-N-(4-naphthalen-1-ylphenyl)aniline;N-(4-carbazol-9-ylphenyl)-4-(4-naphthalen-2-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]aniline;N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-4-phenylaniline
CID 157492697
3-[9-(3-naphthalen-1-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-naphthalen-1-ylphenyl)carbazol-3-yl]-9-phenylcarbazole
CID 159770105
9-(4-naphthalen-1-ylphenyl)-5-phenyl-14-(4-phenylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene
CID 139312614
3-(6,9-diphenylcarbazol-3-yl)-6,9-diphenylcarbazole;3-(7,9-diphenylcarbazol-3-yl)-6,9-diphenylcarbazole;3-(6,9-diphenylcarbazol-3-yl)-6-naphthalen-1-yl-9-phenylcarbazole
CID 157256815
N-(4-carbazol-9-ylphenyl)-4-(4-naphthalen-1-ylphenyl)-N-[4-(6-phenylnaphthalen-2-yl)phenyl]aniline
CID 146580365
3-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole
CID 118231204

Frequently Asked Questions

What is the IUPAC name of 9-(4-naphthalen-1-ylphenyl)-3-(4-naphthalen-2-ylphenyl)-6-phenylcarbazole?
The IUPAC name of 9-(4-naphthalen-1-ylphenyl)-3-(4-naphthalen-2-ylphenyl)-6-phenylcarbazole (CID 177074708) is 9-(4-naphthalen-1-ylphenyl)-3-(4-naphthalen-2-ylphenyl)-6-phenylcarbazole.
What is the SMILES notation for 9-(4-naphthalen-1-ylphenyl)-3-(4-naphthalen-2-ylphenyl)-6-phenylcarbazole?
The canonical SMILES for 9-(4-naphthalen-1-ylphenyl)-3-(4-naphthalen-2-ylphenyl)-6-phenylcarbazole is c1ccc(-c2ccc3c(c2)c2cc(-c4ccc(-c5ccc6ccccc6c5)cc4)ccc2n3-c2ccc(-c3cccc4ccccc34)cc2)cc1.
What is the InChIKey of 9-(4-naphthalen-1-ylphenyl)-3-(4-naphthalen-2-ylphenyl)-6-phenylcarbazole?
The InChIKey is QFJJHLQJCNFXSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H33N/c1-2-9-34(10-3-1)42-25-29-49-47(32-42)48-33-43(37-19-17-36(18-20-37)41-22-21-35-11-4-5-13-40(35)31-41)26-30-50(48)51(49)44-27-23-39(24-28-44)46-16-8-14-38-12-6-7-15-45(38)46/h1-33H.
What are the key properties of 9-(4-naphthalen-1-ylphenyl)-3-(4-naphthalen-2-ylphenyl)-6-phenylcarbazole?
9-(4-naphthalen-1-ylphenyl)-3-(4-naphthalen-2-ylphenyl)-6-phenylcarbazole has a molecular weight of 647.82 g/mol, XLogP of 13.76, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-naphthalen-1-ylphenyl)-3-(4-naphthalen-2-ylphenyl)-6-phenylcarbazole is sourced from PubChem (CID 177074708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).