2-methoxypyridine-3-sulfonyl chloride

C6H6ClNO3S — CID 18366192

IUPAC2-methoxypyridine-3-sulfonyl chloride
SMILESCOc1ncccc1S(=O)(=O)Cl
InChIInChI=1S/C6H6ClNO3S/c1-11-6-5(12(7,9)10)3-2-4-8-6/h2-4H,1H3
InChIKeyLYKXXCYWOSGOIA-UHFFFAOYSA-N
MW207.64 g/mol
LogP1.02
Rot. Bonds2

About 2-methoxypyridine-3-sulfonyl chloride

2-methoxypyridine-3-sulfonyl chloride (PubChem CID 18366192) has the molecular formula C6H6ClNO3S and a molecular weight of 207.64 g/mol. Its IUPAC name is 2-methoxypyridine-3-sulfonyl chloride.

Molecular Properties

Compound Name2-methoxypyridine-3-sulfonyl chloride
PubChem CID18366192
Molecular FormulaC6H6ClNO3S
Molecular Weight207.64 g/mol
Exact Mass206.98
IUPAC Name2-methoxypyridine-3-sulfonyl chloride
SMILESCOc1ncccc1S(=O)(=O)Cl
InChIInChI=1S/C6H6ClNO3S/c1-11-6-5(12(7,9)10)3-2-4-8-6/h2-4H,1H3
InChIKeyLYKXXCYWOSGOIA-UHFFFAOYSA-N
XLogP1.02
TPSA56.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.64
LogP ≤ 51.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methoxypyridine-3-sulfonyl chloride?
The IUPAC name of 2-methoxypyridine-3-sulfonyl chloride (CID 18366192) is 2-methoxypyridine-3-sulfonyl chloride.
What is the SMILES notation for 2-methoxypyridine-3-sulfonyl chloride?
The canonical SMILES for 2-methoxypyridine-3-sulfonyl chloride is COc1ncccc1S(=O)(=O)Cl.
What is the InChIKey of 2-methoxypyridine-3-sulfonyl chloride?
The InChIKey is LYKXXCYWOSGOIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6ClNO3S/c1-11-6-5(12(7,9)10)3-2-4-8-6/h2-4H,1H3.
What are the key properties of 2-methoxypyridine-3-sulfonyl chloride?
2-methoxypyridine-3-sulfonyl chloride has a molecular weight of 207.64 g/mol, XLogP of 1.02, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxypyridine-3-sulfonyl chloride is sourced from PubChem (CID 18366192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).