7-naphthalen-1-yl-5,9-dinaphthalen-2-ylbenzo[c]carbazole

C46H29N — CID 163423913

IUPAC7-naphthalen-1-yl-5,9-dinaphthalen-2-ylbenzo[c]carbazole
SMILESc1ccc2cc(-c3ccc4c5c6ccccc6c(-c6ccc7ccccc7c6)cc5n(-c5cccc6ccccc56)c4c3)ccc2c1
InChIInChI=1S/C46H29N/c1-3-13-33-26-35(22-20-30(33)10-1)36-24-25-41-44(28-36)47(43-19-9-15-32-12-5-6-16-38(32)43)45-29-42(39-17-7-8-18-40(39)46(41)45)37-23-21-31-11-2-4-14-34(31)27-37/h1-29H
InChIKeyAKVQTGXJLYDISY-UHFFFAOYSA-N
MW595.75 g/mol
LogP12.73
Rot. Bonds3

About 7-naphthalen-1-yl-5,9-dinaphthalen-2-ylbenzo[c]carbazole

7-naphthalen-1-yl-5,9-dinaphthalen-2-ylbenzo[c]carbazole (PubChem CID 163423913) has the molecular formula C46H29N and a molecular weight of 595.75 g/mol. Its IUPAC name is 7-naphthalen-1-yl-5,9-dinaphthalen-2-ylbenzo[c]carbazole.

Molecular Properties

Compound Name7-naphthalen-1-yl-5,9-dinaphthalen-2-ylbenzo[c]carbazole
PubChem CID163423913
Molecular FormulaC46H29N
Molecular Weight595.75 g/mol
Exact Mass595.23
IUPAC Name7-naphthalen-1-yl-5,9-dinaphthalen-2-ylbenzo[c]carbazole
SMILESc1ccc2cc(-c3ccc4c5c6ccccc6c(-c6ccc7ccccc7c6)cc5n(-c5cccc6ccccc56)c4c3)ccc2c1
InChIInChI=1S/C46H29N/c1-3-13-33-26-35(22-20-30(33)10-1)36-24-25-41-44(28-36)47(43-19-9-15-32-12-5-6-16-38(32)43)45-29-42(39-17-7-8-18-40(39)46(41)45)37-23-21-31-11-2-4-14-34(31)27-37/h1-29H
InChIKeyAKVQTGXJLYDISY-UHFFFAOYSA-N
XLogP12.73
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms47
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500595.75
LogP ≤ 512.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

7-naphthalen-1-yl-3-(7-naphthalen-2-ylnaphthalen-2-yl)benzo[c]carbazole
CID 130351193
2,7-dinaphthalen-1-ylbenzo[c]carbazole
CID 130351339
7-naphthalen-1-yl-2-(6-phenylnaphthalen-2-yl)benzo[c]carbazole
CID 130350960
9-naphthalen-1-yl-N-(4-naphthalen-2-ylphenyl)-N,7-diphenylcarbazol-2-amine
CID 146573551
9-naphthalen-1-yl-3-(3-naphthalen-1-ylphenyl)carbazole;9-naphthalen-1-yl-3-(3-naphthalen-2-ylphenyl)carbazole;9-naphthalen-1-yl-3-(4-triphenylen-2-ylphenyl)carbazole
CID 158894954
9-naphthalen-1-yl-7-[5-(9-naphthalen-1-ylbenzo[c]carbazol-7-yl)benzo[c]phenanthren-8-yl]benzo[c]carbazole
CID 59156237
2-[9-[2-(3-naphthalen-2-ylphenyl)phenyl]carbazol-2-yl]-9-(2-phenylphenyl)carbazole
CID 142315112
5-[3-(6-methyl-2-pyridinyl)phenyl]-9-naphthalen-2-yl-7-phenylbenzo[c]carbazole
CID 118895360
5-(7H-benzo[c]carbazol-5-yl)-7-phenylbenzo[c]carbazole;4-(7-naphthalen-1-ylbenzo[c]carbazol-5-yl)-N-phenylnaphthalen-2-amine;5-[6-(9-phenylcarbazol-2-yl)naphthalen-2-yl]-7H-benzo[c]carbazole
CID 157339691
3,24-dimethyl-6-naphthalen-1-yl-21-(4-naphthalen-2-ylphenyl)-3,24-diazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18(23),19,21-undecaene
CID 59181664
9-naphthalen-1-yl-3-(4-naphthalen-2-ylphenyl)carbazole;9-naphthalen-1-yl-3-(4-phenanthren-9-ylphenyl)carbazole
CID 160833485
7-naphthalen-1-yl-2-phenylbenzo[c]carbazole
CID 130351033

Frequently Asked Questions

What is the IUPAC name of 7-naphthalen-1-yl-5,9-dinaphthalen-2-ylbenzo[c]carbazole?
The IUPAC name of 7-naphthalen-1-yl-5,9-dinaphthalen-2-ylbenzo[c]carbazole (CID 163423913) is 7-naphthalen-1-yl-5,9-dinaphthalen-2-ylbenzo[c]carbazole.
What is the SMILES notation for 7-naphthalen-1-yl-5,9-dinaphthalen-2-ylbenzo[c]carbazole?
The canonical SMILES for 7-naphthalen-1-yl-5,9-dinaphthalen-2-ylbenzo[c]carbazole is c1ccc2cc(-c3ccc4c5c6ccccc6c(-c6ccc7ccccc7c6)cc5n(-c5cccc6ccccc56)c4c3)ccc2c1.
What is the InChIKey of 7-naphthalen-1-yl-5,9-dinaphthalen-2-ylbenzo[c]carbazole?
The InChIKey is AKVQTGXJLYDISY-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H29N/c1-3-13-33-26-35(22-20-30(33)10-1)36-24-25-41-44(28-36)47(43-19-9-15-32-12-5-6-16-38(32)43)45-29-42(39-17-7-8-18-40(39)46(41)45)37-23-21-31-11-2-4-14-34(31)27-37/h1-29H.
What are the key properties of 7-naphthalen-1-yl-5,9-dinaphthalen-2-ylbenzo[c]carbazole?
7-naphthalen-1-yl-5,9-dinaphthalen-2-ylbenzo[c]carbazole has a molecular weight of 595.75 g/mol, XLogP of 12.73, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-naphthalen-1-yl-5,9-dinaphthalen-2-ylbenzo[c]carbazole is sourced from PubChem (CID 163423913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).