6-dibenzofuran-2-yl-2-naphthalen-2-yl-9-pyridin-2-ylcarbazole

C39H24N2O — CID 163837269

IUPAC6-dibenzofuran-2-yl-2-naphthalen-2-yl-9-pyridin-2-ylcarbazole
SMILESc1ccc(-n2c3ccc(-c4ccc5oc6ccccc6c5c4)cc3c3ccc(-c4ccc5ccccc5c4)cc32)nc1
InChIInChI=1S/C39H24N2O/c1-2-8-26-21-27(13-12-25(26)7-1)30-14-17-31-33-22-28(15-18-35(33)41(36(31)24-30)39-11-5-6-20-40-39)29-16-19-38-34(23-29)32-9-3-4-10-37(32)42-38/h1-24H
InChIKeyOIVRQEJPHFDXTB-UHFFFAOYSA-N
MW536.63 g/mol
LogP10.57
Rot. Bonds3

About 6-dibenzofuran-2-yl-2-naphthalen-2-yl-9-pyridin-2-ylcarbazole

6-dibenzofuran-2-yl-2-naphthalen-2-yl-9-pyridin-2-ylcarbazole (PubChem CID 163837269) has the molecular formula C39H24N2O and a molecular weight of 536.63 g/mol. Its IUPAC name is 6-dibenzofuran-2-yl-2-naphthalen-2-yl-9-pyridin-2-ylcarbazole.

Molecular Properties

Compound Name6-dibenzofuran-2-yl-2-naphthalen-2-yl-9-pyridin-2-ylcarbazole
PubChem CID163837269
Molecular FormulaC39H24N2O
Molecular Weight536.63 g/mol
Exact Mass536.19
IUPAC Name6-dibenzofuran-2-yl-2-naphthalen-2-yl-9-pyridin-2-ylcarbazole
SMILESc1ccc(-n2c3ccc(-c4ccc5oc6ccccc6c5c4)cc3c3ccc(-c4ccc5ccccc5c4)cc32)nc1
InChIInChI=1S/C39H24N2O/c1-2-8-26-21-27(13-12-25(26)7-1)30-14-17-31-33-22-28(15-18-35(33)41(36(31)24-30)39-11-5-6-20-40-39)29-16-19-38-34(23-29)32-9-3-4-10-37(32)42-38/h1-24H
InChIKeyOIVRQEJPHFDXTB-UHFFFAOYSA-N
XLogP10.57
TPSA30.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms42
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500536.63
LogP ≤ 510.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-dibenzofuran-2-yl-2-naphthalen-2-yl-9-pyridin-2-ylcarbazole?
The IUPAC name of 6-dibenzofuran-2-yl-2-naphthalen-2-yl-9-pyridin-2-ylcarbazole (CID 163837269) is 6-dibenzofuran-2-yl-2-naphthalen-2-yl-9-pyridin-2-ylcarbazole.
What is the SMILES notation for 6-dibenzofuran-2-yl-2-naphthalen-2-yl-9-pyridin-2-ylcarbazole?
The canonical SMILES for 6-dibenzofuran-2-yl-2-naphthalen-2-yl-9-pyridin-2-ylcarbazole is c1ccc(-n2c3ccc(-c4ccc5oc6ccccc6c5c4)cc3c3ccc(-c4ccc5ccccc5c4)cc32)nc1.
What is the InChIKey of 6-dibenzofuran-2-yl-2-naphthalen-2-yl-9-pyridin-2-ylcarbazole?
The InChIKey is OIVRQEJPHFDXTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H24N2O/c1-2-8-26-21-27(13-12-25(26)7-1)30-14-17-31-33-22-28(15-18-35(33)41(36(31)24-30)39-11-5-6-20-40-39)29-16-19-38-34(23-29)32-9-3-4-10-37(32)42-38/h1-24H.
What are the key properties of 6-dibenzofuran-2-yl-2-naphthalen-2-yl-9-pyridin-2-ylcarbazole?
6-dibenzofuran-2-yl-2-naphthalen-2-yl-9-pyridin-2-ylcarbazole has a molecular weight of 536.63 g/mol, XLogP of 10.57, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-dibenzofuran-2-yl-2-naphthalen-2-yl-9-pyridin-2-ylcarbazole is sourced from PubChem (CID 163837269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).