6-methylquinoline-8-sulfonyl fluoride

C10H8FNO2S — CID 165453594

IUPAC6-methylquinoline-8-sulfonyl fluoride
SMILESCc1cc(S(=O)(=O)F)c2ncccc2c1
InChIInChI=1S/C10H8FNO2S/c1-7-5-8-3-2-4-12-10(8)9(6-7)15(11,13)14/h2-6H,1H3
InChIKeyCLDDLOYHGALEQX-UHFFFAOYSA-N
MW225.24 g/mol
LogP2.20
Rot. Bonds1

About 6-methylquinoline-8-sulfonyl fluoride

6-methylquinoline-8-sulfonyl fluoride (PubChem CID 165453594) has the molecular formula C10H8FNO2S and a molecular weight of 225.24 g/mol. Its IUPAC name is 6-methylquinoline-8-sulfonyl fluoride.

Molecular Properties

Compound Name6-methylquinoline-8-sulfonyl fluoride
PubChem CID165453594
Molecular FormulaC10H8FNO2S
Molecular Weight225.24 g/mol
Exact Mass225.03
IUPAC Name6-methylquinoline-8-sulfonyl fluoride
SMILESCc1cc(S(=O)(=O)F)c2ncccc2c1
InChIInChI=1S/C10H8FNO2S/c1-7-5-8-3-2-4-12-10(8)9(6-7)15(11,13)14/h2-6H,1H3
InChIKeyCLDDLOYHGALEQX-UHFFFAOYSA-N
XLogP2.20
TPSA47.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.24
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methylquinoline-8-sulfonyl fluoride?
The IUPAC name of 6-methylquinoline-8-sulfonyl fluoride (CID 165453594) is 6-methylquinoline-8-sulfonyl fluoride.
What is the SMILES notation for 6-methylquinoline-8-sulfonyl fluoride?
The canonical SMILES for 6-methylquinoline-8-sulfonyl fluoride is Cc1cc(S(=O)(=O)F)c2ncccc2c1.
What is the InChIKey of 6-methylquinoline-8-sulfonyl fluoride?
The InChIKey is CLDDLOYHGALEQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FNO2S/c1-7-5-8-3-2-4-12-10(8)9(6-7)15(11,13)14/h2-6H,1H3.
What are the key properties of 6-methylquinoline-8-sulfonyl fluoride?
6-methylquinoline-8-sulfonyl fluoride has a molecular weight of 225.24 g/mol, XLogP of 2.20, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylquinoline-8-sulfonyl fluoride is sourced from PubChem (CID 165453594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).