6-fluoro-2,5-dimethylquinoline

C11H10FN — CID 19868176

IUPAC6-fluoro-2,5-dimethylquinoline
SMILESCc1ccc2c(C)c(F)ccc2n1
InChIInChI=1S/C11H10FN/c1-7-3-4-9-8(2)10(12)5-6-11(9)13-7/h3-6H,1-2H3
InChIKeyATWVWVWZFFCWOV-UHFFFAOYSA-N
MW175.21 g/mol
LogP2.99
Rot. Bonds

About 6-fluoro-2,5-dimethylquinoline

6-fluoro-2,5-dimethylquinoline (PubChem CID 19868176) has the molecular formula C11H10FN and a molecular weight of 175.21 g/mol. Its IUPAC name is 6-fluoro-2,5-dimethylquinoline.

Molecular Properties

Compound Name6-fluoro-2,5-dimethylquinoline
PubChem CID19868176
Molecular FormulaC11H10FN
Molecular Weight175.21 g/mol
Exact Mass175.08
IUPAC Name6-fluoro-2,5-dimethylquinoline
SMILESCc1ccc2c(C)c(F)ccc2n1
InChIInChI=1S/C11H10FN/c1-7-3-4-9-8(2)10(12)5-6-11(9)13-7/h3-6H,1-2H3
InChIKeyATWVWVWZFFCWOV-UHFFFAOYSA-N
XLogP2.99
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.21
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2,5-dimethylquinoline?
The IUPAC name of 6-fluoro-2,5-dimethylquinoline (CID 19868176) is 6-fluoro-2,5-dimethylquinoline.
What is the SMILES notation for 6-fluoro-2,5-dimethylquinoline?
The canonical SMILES for 6-fluoro-2,5-dimethylquinoline is Cc1ccc2c(C)c(F)ccc2n1.
What is the InChIKey of 6-fluoro-2,5-dimethylquinoline?
The InChIKey is ATWVWVWZFFCWOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FN/c1-7-3-4-9-8(2)10(12)5-6-11(9)13-7/h3-6H,1-2H3.
What are the key properties of 6-fluoro-2,5-dimethylquinoline?
6-fluoro-2,5-dimethylquinoline has a molecular weight of 175.21 g/mol, XLogP of 2.99, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2,5-dimethylquinoline is sourced from PubChem (CID 19868176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).