6-fluoro-3-methyl-2-(3-methylphenyl)quinoline

C17H14FN — CID 59288886

IUPAC6-fluoro-3-methyl-2-(3-methylphenyl)quinoline
SMILESCc1cccc(-c2nc3ccc(F)cc3cc2C)c1
InChIInChI=1S/C17H14FN/c1-11-4-3-5-13(8-11)17-12(2)9-14-10-15(18)6-7-16(14)19-17/h3-10H,1-2H3
InChIKeyOIEKTYMBCNDFOG-UHFFFAOYSA-N
MW251.30 g/mol
LogP4.66
Rot. Bonds1

About 6-fluoro-3-methyl-2-(3-methylphenyl)quinoline

6-fluoro-3-methyl-2-(3-methylphenyl)quinoline (PubChem CID 59288886) has the molecular formula C17H14FN and a molecular weight of 251.30 g/mol. Its IUPAC name is 6-fluoro-3-methyl-2-(3-methylphenyl)quinoline.

Molecular Properties

Compound Name6-fluoro-3-methyl-2-(3-methylphenyl)quinoline
PubChem CID59288886
Molecular FormulaC17H14FN
Molecular Weight251.30 g/mol
Exact Mass251.11
IUPAC Name6-fluoro-3-methyl-2-(3-methylphenyl)quinoline
SMILESCc1cccc(-c2nc3ccc(F)cc3cc2C)c1
InChIInChI=1S/C17H14FN/c1-11-4-3-5-13(8-11)17-12(2)9-14-10-15(18)6-7-16(14)19-17/h3-10H,1-2H3
InChIKeyOIEKTYMBCNDFOG-UHFFFAOYSA-N
XLogP4.66
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.30
LogP ≤ 54.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-3-methyl-2-(3-methylphenyl)quinoline?
The IUPAC name of 6-fluoro-3-methyl-2-(3-methylphenyl)quinoline (CID 59288886) is 6-fluoro-3-methyl-2-(3-methylphenyl)quinoline.
What is the SMILES notation for 6-fluoro-3-methyl-2-(3-methylphenyl)quinoline?
The canonical SMILES for 6-fluoro-3-methyl-2-(3-methylphenyl)quinoline is Cc1cccc(-c2nc3ccc(F)cc3cc2C)c1.
What is the InChIKey of 6-fluoro-3-methyl-2-(3-methylphenyl)quinoline?
The InChIKey is OIEKTYMBCNDFOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FN/c1-11-4-3-5-13(8-11)17-12(2)9-14-10-15(18)6-7-16(14)19-17/h3-10H,1-2H3.
What are the key properties of 6-fluoro-3-methyl-2-(3-methylphenyl)quinoline?
6-fluoro-3-methyl-2-(3-methylphenyl)quinoline has a molecular weight of 251.30 g/mol, XLogP of 4.66, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-3-methyl-2-(3-methylphenyl)quinoline is sourced from PubChem (CID 59288886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).