2-fluoro-9-(2-fluorophenyl)-3,6-dimethylcarbazole

C20H15F2N — CID 146656306

IUPAC2-fluoro-9-(2-fluorophenyl)-3,6-dimethylcarbazole
SMILESCc1ccc2c(c1)c1cc(C)c(F)cc1n2-c1ccccc1F
InChIInChI=1S/C20H15F2N/c1-12-7-8-18-14(9-12)15-10-13(2)17(22)11-20(15)23(18)19-6-4-3-5-16(19)21/h3-11H,1-2H3
InChIKeyYSVQLNUDSJGEFT-UHFFFAOYSA-N
MW307.34 g/mol
LogP5.68
Rot. Bonds1

About 2-fluoro-9-(2-fluorophenyl)-3,6-dimethylcarbazole

2-fluoro-9-(2-fluorophenyl)-3,6-dimethylcarbazole (PubChem CID 146656306) has the molecular formula C20H15F2N and a molecular weight of 307.34 g/mol. Its IUPAC name is 2-fluoro-9-(2-fluorophenyl)-3,6-dimethylcarbazole.

Molecular Properties

Compound Name2-fluoro-9-(2-fluorophenyl)-3,6-dimethylcarbazole
PubChem CID146656306
Molecular FormulaC20H15F2N
Molecular Weight307.34 g/mol
Exact Mass307.12
IUPAC Name2-fluoro-9-(2-fluorophenyl)-3,6-dimethylcarbazole
SMILESCc1ccc2c(c1)c1cc(C)c(F)cc1n2-c1ccccc1F
InChIInChI=1S/C20H15F2N/c1-12-7-8-18-14(9-12)15-10-13(2)17(22)11-20(15)23(18)19-6-4-3-5-16(19)21/h3-11H,1-2H3
InChIKeyYSVQLNUDSJGEFT-UHFFFAOYSA-N
XLogP5.68
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms23
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500307.34
LogP ≤ 55.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-9-(2-fluorophenyl)-3,6-dimethylcarbazole?
The IUPAC name of 2-fluoro-9-(2-fluorophenyl)-3,6-dimethylcarbazole (CID 146656306) is 2-fluoro-9-(2-fluorophenyl)-3,6-dimethylcarbazole.
What is the SMILES notation for 2-fluoro-9-(2-fluorophenyl)-3,6-dimethylcarbazole?
The canonical SMILES for 2-fluoro-9-(2-fluorophenyl)-3,6-dimethylcarbazole is Cc1ccc2c(c1)c1cc(C)c(F)cc1n2-c1ccccc1F.
What is the InChIKey of 2-fluoro-9-(2-fluorophenyl)-3,6-dimethylcarbazole?
The InChIKey is YSVQLNUDSJGEFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15F2N/c1-12-7-8-18-14(9-12)15-10-13(2)17(22)11-20(15)23(18)19-6-4-3-5-16(19)21/h3-11H,1-2H3.
What are the key properties of 2-fluoro-9-(2-fluorophenyl)-3,6-dimethylcarbazole?
2-fluoro-9-(2-fluorophenyl)-3,6-dimethylcarbazole has a molecular weight of 307.34 g/mol, XLogP of 5.68, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-9-(2-fluorophenyl)-3,6-dimethylcarbazole is sourced from PubChem (CID 146656306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).