2-methylquinoline-6-sulfonyl chloride

C10H8ClNO2S — CID 53433228

IUPAC2-methylquinoline-6-sulfonyl chloride
SMILESCc1ccc2cc(S(=O)(=O)Cl)ccc2n1
InChIInChI=1S/C10H8ClNO2S/c1-7-2-3-8-6-9(15(11,13)14)4-5-10(8)12-7/h2-6H,1H3
InChIKeyINCCUGMUEJWWJS-UHFFFAOYSA-N
MW241.70 g/mol
LogP2.47
Rot. Bonds1

About 2-methylquinoline-6-sulfonyl chloride

2-methylquinoline-6-sulfonyl chloride (PubChem CID 53433228) has the molecular formula C10H8ClNO2S and a molecular weight of 241.70 g/mol. Its IUPAC name is 2-methylquinoline-6-sulfonyl chloride.

Molecular Properties

Compound Name2-methylquinoline-6-sulfonyl chloride
PubChem CID53433228
Molecular FormulaC10H8ClNO2S
Molecular Weight241.70 g/mol
Exact Mass241.00
IUPAC Name2-methylquinoline-6-sulfonyl chloride
SMILESCc1ccc2cc(S(=O)(=O)Cl)ccc2n1
InChIInChI=1S/C10H8ClNO2S/c1-7-2-3-8-6-9(15(11,13)14)4-5-10(8)12-7/h2-6H,1H3
InChIKeyINCCUGMUEJWWJS-UHFFFAOYSA-N
XLogP2.47
TPSA47.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.70
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methylquinoline-6-sulfonyl chloride?
The IUPAC name of 2-methylquinoline-6-sulfonyl chloride (CID 53433228) is 2-methylquinoline-6-sulfonyl chloride.
What is the SMILES notation for 2-methylquinoline-6-sulfonyl chloride?
The canonical SMILES for 2-methylquinoline-6-sulfonyl chloride is Cc1ccc2cc(S(=O)(=O)Cl)ccc2n1.
What is the InChIKey of 2-methylquinoline-6-sulfonyl chloride?
The InChIKey is INCCUGMUEJWWJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClNO2S/c1-7-2-3-8-6-9(15(11,13)14)4-5-10(8)12-7/h2-6H,1H3.
What are the key properties of 2-methylquinoline-6-sulfonyl chloride?
2-methylquinoline-6-sulfonyl chloride has a molecular weight of 241.70 g/mol, XLogP of 2.47, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylquinoline-6-sulfonyl chloride is sourced from PubChem (CID 53433228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).