2,7-dinaphthalen-1-ylbenzo[c]carbazole

C36H23N — CID 130351339

IUPAC2,7-dinaphthalen-1-ylbenzo[c]carbazole
SMILESc1ccc2c(-c3ccc4ccc5c(c4c3)c3ccccc3n5-c3cccc4ccccc34)cccc2c1
InChIInChI=1S/C36H23N/c1-3-13-28-24(9-1)11-7-16-29(28)27-20-19-26-21-22-35-36(32(26)23-27)31-15-5-6-17-34(31)37(35)33-18-8-12-25-10-2-4-14-30(25)33/h1-23H
InChIKeyDLWYCKFMBXQOCR-UHFFFAOYSA-N
MW469.59 g/mol
LogP9.91
Rot. Bonds2

About 2,7-dinaphthalen-1-ylbenzo[c]carbazole

2,7-dinaphthalen-1-ylbenzo[c]carbazole (PubChem CID 130351339) has the molecular formula C36H23N and a molecular weight of 469.59 g/mol. Its IUPAC name is 2,7-dinaphthalen-1-ylbenzo[c]carbazole.

Molecular Properties

Compound Name2,7-dinaphthalen-1-ylbenzo[c]carbazole
PubChem CID130351339
Molecular FormulaC36H23N
Molecular Weight469.59 g/mol
Exact Mass469.18
IUPAC Name2,7-dinaphthalen-1-ylbenzo[c]carbazole
SMILESc1ccc2c(-c3ccc4ccc5c(c4c3)c3ccccc3n5-c3cccc4ccccc34)cccc2c1
InChIInChI=1S/C36H23N/c1-3-13-28-24(9-1)11-7-16-29(28)27-20-19-26-21-22-35-36(32(26)23-27)31-15-5-6-17-34(31)37(35)33-18-8-12-25-10-2-4-14-30(25)33/h1-23H
InChIKeyDLWYCKFMBXQOCR-UHFFFAOYSA-N
XLogP9.91
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms37
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500469.59
LogP ≤ 59.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,7-dinaphthalen-1-ylbenzo[c]carbazole?
The IUPAC name of 2,7-dinaphthalen-1-ylbenzo[c]carbazole (CID 130351339) is 2,7-dinaphthalen-1-ylbenzo[c]carbazole.
What is the SMILES notation for 2,7-dinaphthalen-1-ylbenzo[c]carbazole?
The canonical SMILES for 2,7-dinaphthalen-1-ylbenzo[c]carbazole is c1ccc2c(-c3ccc4ccc5c(c4c3)c3ccccc3n5-c3cccc4ccccc34)cccc2c1.
What is the InChIKey of 2,7-dinaphthalen-1-ylbenzo[c]carbazole?
The InChIKey is DLWYCKFMBXQOCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H23N/c1-3-13-28-24(9-1)11-7-16-29(28)27-20-19-26-21-22-35-36(32(26)23-27)31-15-5-6-17-34(31)37(35)33-18-8-12-25-10-2-4-14-30(25)33/h1-23H.
What are the key properties of 2,7-dinaphthalen-1-ylbenzo[c]carbazole?
2,7-dinaphthalen-1-ylbenzo[c]carbazole has a molecular weight of 469.59 g/mol, XLogP of 9.91, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-dinaphthalen-1-ylbenzo[c]carbazole is sourced from PubChem (CID 130351339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).