6,8-difluoro-2,4-dimethylquinoline;ethane

C13H15F2N — CID 145015190

IUPAC6,8-difluoro-2,4-dimethylquinoline;ethane
SMILESCC.Cc1cc(C)c2cc(F)cc(F)c2n1
InChIInChI=1S/C11H9F2N.C2H6/c1-6-3-7(2)14-11-9(6)4-8(12)5-10(11)13;1-2/h3-5H,1-2H3;1-2H3
InChIKeyZLJDCWRBHBIMGP-UHFFFAOYSA-N
MW223.27 g/mol
LogP4.16
Rot. Bonds

About 6,8-difluoro-2,4-dimethylquinoline;ethane

6,8-difluoro-2,4-dimethylquinoline;ethane (PubChem CID 145015190) has the molecular formula C13H15F2N and a molecular weight of 223.27 g/mol. Its IUPAC name is 6,8-difluoro-2,4-dimethylquinoline;ethane.

Molecular Properties

Compound Name6,8-difluoro-2,4-dimethylquinoline;ethane
PubChem CID145015190
Molecular FormulaC13H15F2N
Molecular Weight223.27 g/mol
Exact Mass223.12
IUPAC Name6,8-difluoro-2,4-dimethylquinoline;ethane
SMILESCC.Cc1cc(C)c2cc(F)cc(F)c2n1
InChIInChI=1S/C11H9F2N.C2H6/c1-6-3-7(2)14-11-9(6)4-8(12)5-10(11)13;1-2/h3-5H,1-2H3;1-2H3
InChIKeyZLJDCWRBHBIMGP-UHFFFAOYSA-N
XLogP4.16
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.27
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6,8-difluoro-2,4-dimethylquinoline;ethane?
The IUPAC name of 6,8-difluoro-2,4-dimethylquinoline;ethane (CID 145015190) is 6,8-difluoro-2,4-dimethylquinoline;ethane.
What is the SMILES notation for 6,8-difluoro-2,4-dimethylquinoline;ethane?
The canonical SMILES for 6,8-difluoro-2,4-dimethylquinoline;ethane is CC.Cc1cc(C)c2cc(F)cc(F)c2n1.
What is the InChIKey of 6,8-difluoro-2,4-dimethylquinoline;ethane?
The InChIKey is ZLJDCWRBHBIMGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9F2N.C2H6/c1-6-3-7(2)14-11-9(6)4-8(12)5-10(11)13;1-2/h3-5H,1-2H3;1-2H3.
What are the key properties of 6,8-difluoro-2,4-dimethylquinoline;ethane?
6,8-difluoro-2,4-dimethylquinoline;ethane has a molecular weight of 223.27 g/mol, XLogP of 4.16, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-difluoro-2,4-dimethylquinoline;ethane is sourced from PubChem (CID 145015190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).