3,6-dinaphthalen-2-yl-9H-carbazole

C32H21N — CID 86019382

IUPAC3,6-dinaphthalen-2-yl-9H-carbazole
SMILESc1ccc2cc(-c3ccc4[nH]c5ccc(-c6ccc7ccccc7c6)cc5c4c3)ccc2c1
InChIInChI=1S/C32H21N/c1-3-7-23-17-25(11-9-21(23)5-1)27-13-15-31-29(19-27)30-20-28(14-16-32(30)33-31)26-12-10-22-6-2-4-8-24(22)18-26/h1-20,33H
InChIKeyRUHSKIVDHMAAKE-UHFFFAOYSA-N
MW419.53 g/mol
LogP8.96
Rot. Bonds2

About 3,6-dinaphthalen-2-yl-9H-carbazole

3,6-dinaphthalen-2-yl-9H-carbazole (PubChem CID 86019382) has the molecular formula C32H21N and a molecular weight of 419.53 g/mol. Its IUPAC name is 3,6-dinaphthalen-2-yl-9H-carbazole.

Molecular Properties

Compound Name3,6-dinaphthalen-2-yl-9H-carbazole
PubChem CID86019382
Molecular FormulaC32H21N
Molecular Weight419.53 g/mol
Exact Mass419.17
IUPAC Name3,6-dinaphthalen-2-yl-9H-carbazole
SMILESc1ccc2cc(-c3ccc4[nH]c5ccc(-c6ccc7ccccc7c6)cc5c4c3)ccc2c1
InChIInChI=1S/C32H21N/c1-3-7-23-17-25(11-9-21(23)5-1)27-13-15-31-29(19-27)30-20-28(14-16-32(30)33-31)26-12-10-22-6-2-4-8-24(22)18-26/h1-20,33H
InChIKeyRUHSKIVDHMAAKE-UHFFFAOYSA-N
XLogP8.96
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500419.53
LogP ≤ 58.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

10-naphthalen-2-yl-7H-benzo[c]carbazole
CID 144640313
3-(3,5-diphenylphenyl)-6-phenyl-9H-carbazole
CID 176723947
8-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-11H-benzo[a]carbazole
CID 90433601
2,8-dinaphthalen-2-yldibenzothiophene
CID 58971417
3-naphthalen-1-yl-6-phenyl-9H-carbazole
CID 118099289
2-[10-(4-phenylphenyl)anthracen-9-yl]-5H-benzo[b]carbazole
CID 90433276
2,7,9,10-tetranaphthalen-2-ylphenanthrene
CID 21136771
2-(3-naphthalen-2-yl-5-triphenylen-2-ylphenyl)triphenylene
CID 123747688
benzo[f]azulene
CID 13065869
benzene;ethane;3-(4-methylphenyl)-6-phenyl-9H-carbazole
CID 143905034
17-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene
CID 90433565
4,15,21,32-tetrazaoctacyclo[16.16.0.03,16.05,14.07,12.020,33.022,31.024,29]tetratriaconta-1,3(16),5,7,9,11,13,17,19,22,24,26,28,30,33-pentadecaene
CID 132514224

Frequently Asked Questions

What is the IUPAC name of 3,6-dinaphthalen-2-yl-9H-carbazole?
The IUPAC name of 3,6-dinaphthalen-2-yl-9H-carbazole (CID 86019382) is 3,6-dinaphthalen-2-yl-9H-carbazole.
What is the SMILES notation for 3,6-dinaphthalen-2-yl-9H-carbazole?
The canonical SMILES for 3,6-dinaphthalen-2-yl-9H-carbazole is c1ccc2cc(-c3ccc4[nH]c5ccc(-c6ccc7ccccc7c6)cc5c4c3)ccc2c1.
What is the InChIKey of 3,6-dinaphthalen-2-yl-9H-carbazole?
The InChIKey is RUHSKIVDHMAAKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H21N/c1-3-7-23-17-25(11-9-21(23)5-1)27-13-15-31-29(19-27)30-20-28(14-16-32(30)33-31)26-12-10-22-6-2-4-8-24(22)18-26/h1-20,33H.
What are the key properties of 3,6-dinaphthalen-2-yl-9H-carbazole?
3,6-dinaphthalen-2-yl-9H-carbazole has a molecular weight of 419.53 g/mol, XLogP of 8.96, 2 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dinaphthalen-2-yl-9H-carbazole is sourced from PubChem (CID 86019382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).