3-(6-naphthalen-1-ylnaphthalen-2-yl)-7-phenylbenzo[c]carbazole

C42H27N — CID 130351343

IUPAC3-(6-naphthalen-1-ylnaphthalen-2-yl)-7-phenylbenzo[c]carbazole
SMILESc1ccc(-n2c3ccccc3c3c4ccc(-c5ccc6cc(-c7cccc8ccccc78)ccc6c5)cc4ccc32)cc1
InChIInChI=1S/C42H27N/c1-2-11-35(12-3-1)43-40-16-7-6-14-39(40)42-38-23-21-32(27-34(38)22-24-41(42)43)29-17-18-31-26-33(20-19-30(31)25-29)37-15-8-10-28-9-4-5-13-36(28)37/h1-27H
InChIKeyOZJGBINKNGFRDL-UHFFFAOYSA-N
MW545.69 g/mol
LogP11.58
Rot. Bonds3

About 3-(6-naphthalen-1-ylnaphthalen-2-yl)-7-phenylbenzo[c]carbazole

3-(6-naphthalen-1-ylnaphthalen-2-yl)-7-phenylbenzo[c]carbazole (PubChem CID 130351343) has the molecular formula C42H27N and a molecular weight of 545.69 g/mol. Its IUPAC name is 3-(6-naphthalen-1-ylnaphthalen-2-yl)-7-phenylbenzo[c]carbazole.

Molecular Properties

Compound Name3-(6-naphthalen-1-ylnaphthalen-2-yl)-7-phenylbenzo[c]carbazole
PubChem CID130351343
Molecular FormulaC42H27N
Molecular Weight545.69 g/mol
Exact Mass545.21
IUPAC Name3-(6-naphthalen-1-ylnaphthalen-2-yl)-7-phenylbenzo[c]carbazole
SMILESc1ccc(-n2c3ccccc3c3c4ccc(-c5ccc6cc(-c7cccc8ccccc78)ccc6c5)cc4ccc32)cc1
InChIInChI=1S/C42H27N/c1-2-11-35(12-3-1)43-40-16-7-6-14-39(40)42-38-23-21-32(27-34(38)22-24-41(42)43)29-17-18-31-26-33(20-19-30(31)25-29)37-15-8-10-28-9-4-5-13-36(28)37/h1-27H
InChIKeyOZJGBINKNGFRDL-UHFFFAOYSA-N
XLogP11.58
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500545.69
LogP ≤ 511.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(6-naphthalen-1-ylnaphthalen-2-yl)-7-phenylbenzo[c]carbazole
CID 130351342
7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(6-naphthalen-1-ylnaphthalen-2-yl)benzo[c]carbazole
CID 130351461
7-phenyl-3-(7-phenylbenzo[c]carbazol-10-yl)benzo[c]carbazole;7-phenyl-2-(7-phenylbenzo[g]carbazol-9-yl)benzo[c]carbazole;7-phenyl-3-(7-phenylbenzo[g]carbazol-9-yl)benzo[c]carbazole
CID 159885247
7-phenyl-3-(7-phenylbenzo[c]carbazol-10-yl)benzo[c]carbazole
CID 130351055
N-(4-naphthalen-1-ylphenyl)-N-phenyl-3-(7-phenylbenzo[c]carbazol-3-yl)aniline
CID 170177898
7-naphthalen-2-yl-2-(7-naphthalen-1-ylnaphthalen-2-yl)benzo[c]carbazole
CID 130351413
15-phenyl-8-[4-(9-phenylcarbazol-2-yl)phenyl]-15-azahexacyclo[12.11.0.02,11.04,9.016,25.019,24]pentacosa-1(14),2(11),3,5,7,9,12,16(25),17,19,21,23-dodecaene
CID 164740406
12-phenyl-7-(9-phenylcarbazol-3-yl)-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16,18,20-decaene
CID 121246518
7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(7-naphthalen-1-ylnaphthalen-2-yl)benzo[c]carbazole
CID 130351208
9-naphthalen-1-yl-7-[3-[4-phenyl-6-(6-phenylnaphthalen-2-yl)-1,3,5-triazin-2-yl]phenyl]benzo[c]carbazole
CID 167031844
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
9-(3-naphthalen-1-ylphenyl)-14-(4-phenylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-(3-naphthalen-2-ylphenyl)-14-(4-phenylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-(4-naphthalen-2-ylphenyl)-14-(4-phenylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-(4-phenylnaphthalen-1-yl)-14-(4-phenylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 163997723

Frequently Asked Questions

What is the IUPAC name of 3-(6-naphthalen-1-ylnaphthalen-2-yl)-7-phenylbenzo[c]carbazole?
The IUPAC name of 3-(6-naphthalen-1-ylnaphthalen-2-yl)-7-phenylbenzo[c]carbazole (CID 130351343) is 3-(6-naphthalen-1-ylnaphthalen-2-yl)-7-phenylbenzo[c]carbazole.
What is the SMILES notation for 3-(6-naphthalen-1-ylnaphthalen-2-yl)-7-phenylbenzo[c]carbazole?
The canonical SMILES for 3-(6-naphthalen-1-ylnaphthalen-2-yl)-7-phenylbenzo[c]carbazole is c1ccc(-n2c3ccccc3c3c4ccc(-c5ccc6cc(-c7cccc8ccccc78)ccc6c5)cc4ccc32)cc1.
What is the InChIKey of 3-(6-naphthalen-1-ylnaphthalen-2-yl)-7-phenylbenzo[c]carbazole?
The InChIKey is OZJGBINKNGFRDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H27N/c1-2-11-35(12-3-1)43-40-16-7-6-14-39(40)42-38-23-21-32(27-34(38)22-24-41(42)43)29-17-18-31-26-33(20-19-30(31)25-29)37-15-8-10-28-9-4-5-13-36(28)37/h1-27H.
What are the key properties of 3-(6-naphthalen-1-ylnaphthalen-2-yl)-7-phenylbenzo[c]carbazole?
3-(6-naphthalen-1-ylnaphthalen-2-yl)-7-phenylbenzo[c]carbazole has a molecular weight of 545.69 g/mol, XLogP of 11.58, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-naphthalen-1-ylnaphthalen-2-yl)-7-phenylbenzo[c]carbazole is sourced from PubChem (CID 130351343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).