9-dibenzofuran-2-yl-3-methylcarbazole

C25H17NO — CID 90211137

IUPAC9-dibenzofuran-2-yl-3-methylcarbazole
SMILESCc1ccc2c(c1)c1ccccc1n2-c1ccc2oc3ccccc3c2c1
InChIInChI=1S/C25H17NO/c1-16-10-12-23-20(14-16)18-6-2-4-8-22(18)26(23)17-11-13-25-21(15-17)19-7-3-5-9-24(19)27-25/h2-15H,1H3
InChIKeyNIQMVNLGAKVGGC-UHFFFAOYSA-N
MW347.42 g/mol
LogP6.99
Rot. Bonds1

About 9-dibenzofuran-2-yl-3-methylcarbazole

9-dibenzofuran-2-yl-3-methylcarbazole (PubChem CID 90211137) has the molecular formula C25H17NO and a molecular weight of 347.42 g/mol. Its IUPAC name is 9-dibenzofuran-2-yl-3-methylcarbazole.

Molecular Properties

Compound Name9-dibenzofuran-2-yl-3-methylcarbazole
PubChem CID90211137
Molecular FormulaC25H17NO
Molecular Weight347.42 g/mol
Exact Mass347.13
IUPAC Name9-dibenzofuran-2-yl-3-methylcarbazole
SMILESCc1ccc2c(c1)c1ccccc1n2-c1ccc2oc3ccccc3c2c1
InChIInChI=1S/C25H17NO/c1-16-10-12-23-20(14-16)18-6-2-4-8-22(18)26(23)17-11-13-25-21(15-17)19-7-3-5-9-24(19)27-25/h2-15H,1H3
InChIKeyNIQMVNLGAKVGGC-UHFFFAOYSA-N
XLogP6.99
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500347.42
LogP ≤ 56.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-dibenzofuran-2-yl-3-methylcarbazole?
The IUPAC name of 9-dibenzofuran-2-yl-3-methylcarbazole (CID 90211137) is 9-dibenzofuran-2-yl-3-methylcarbazole.
What is the SMILES notation for 9-dibenzofuran-2-yl-3-methylcarbazole?
The canonical SMILES for 9-dibenzofuran-2-yl-3-methylcarbazole is Cc1ccc2c(c1)c1ccccc1n2-c1ccc2oc3ccccc3c2c1.
What is the InChIKey of 9-dibenzofuran-2-yl-3-methylcarbazole?
The InChIKey is NIQMVNLGAKVGGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H17NO/c1-16-10-12-23-20(14-16)18-6-2-4-8-22(18)26(23)17-11-13-25-21(15-17)19-7-3-5-9-24(19)27-25/h2-15H,1H3.
What are the key properties of 9-dibenzofuran-2-yl-3-methylcarbazole?
9-dibenzofuran-2-yl-3-methylcarbazole has a molecular weight of 347.42 g/mol, XLogP of 6.99, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-dibenzofuran-2-yl-3-methylcarbazole is sourced from PubChem (CID 90211137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).