2-methoxy-5-methylsulfonylpyridine

C7H9NO3S — CID 13433434

IUPAC2-methoxy-5-methylsulfonylpyridine
SMILESCOc1ccc(S(C)(=O)=O)cn1
InChIInChI=1S/C7H9NO3S/c1-11-7-4-3-6(5-8-7)12(2,9)10/h3-5H,1-2H3
InChIKeyXPNAEADWDCOONK-UHFFFAOYSA-N
MW187.22 g/mol
LogP0.49
Rot. Bonds2

About 2-methoxy-5-methylsulfonylpyridine

2-methoxy-5-methylsulfonylpyridine (PubChem CID 13433434) has the molecular formula C7H9NO3S and a molecular weight of 187.22 g/mol. Its IUPAC name is 2-methoxy-5-methylsulfonylpyridine.

Molecular Properties

Compound Name2-methoxy-5-methylsulfonylpyridine
PubChem CID13433434
Molecular FormulaC7H9NO3S
Molecular Weight187.22 g/mol
Exact Mass187.03
IUPAC Name2-methoxy-5-methylsulfonylpyridine
SMILESCOc1ccc(S(C)(=O)=O)cn1
InChIInChI=1S/C7H9NO3S/c1-11-7-4-3-6(5-8-7)12(2,9)10/h3-5H,1-2H3
InChIKeyXPNAEADWDCOONK-UHFFFAOYSA-N
XLogP0.49
TPSA56.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.22
LogP ≤ 50.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-(6-methoxy-3-pyridinyl)-5-(4-methylsulfonylphenyl)-1H-pyridin-2-one
CID 72711196
2-methoxy-5-piperidin-1-ylsulfonylpyridine
CID 5268012
2-(2-cyclopropylethoxy)-5-methylsulfonylpyridine
CID 123409029
4-(6-methoxy-3-pyridinyl)-3-(4-methylsulfonylphenyl)pyridin-2-amine
CID 123572941
1-[(6-methoxy-3-pyridinyl)sulfonyl]piperidin-4-one
CID 69088398
(2S)-2-[(6-methoxy-3-pyridinyl)sulfonylamino]propanoic acid
CID 122069805
6-amino-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide
CID 62149708
N-ethyl-6-methoxy-N-phenylpyridine-3-sulfonamide
CID 5268434
6-methoxy-N-methyl-N-piperidin-4-ylpyridine-3-sulfonamide
CID 120999712
[4-[(5-methylsulfonyl-2-pyridinyl)oxy]phenyl]-phenylmethanone
CID 511923
3-[(6-methoxy-3-pyridinyl)sulfonylamino]cyclobutane-1-carboxylic acid
CID 146102616
2-methylsulfanyl-5-methylsulfonylpyridine
CID 129046719

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-methylsulfonylpyridine?
The IUPAC name of 2-methoxy-5-methylsulfonylpyridine (CID 13433434) is 2-methoxy-5-methylsulfonylpyridine.
What is the SMILES notation for 2-methoxy-5-methylsulfonylpyridine?
The canonical SMILES for 2-methoxy-5-methylsulfonylpyridine is COc1ccc(S(C)(=O)=O)cn1.
What is the InChIKey of 2-methoxy-5-methylsulfonylpyridine?
The InChIKey is XPNAEADWDCOONK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NO3S/c1-11-7-4-3-6(5-8-7)12(2,9)10/h3-5H,1-2H3.
What are the key properties of 2-methoxy-5-methylsulfonylpyridine?
2-methoxy-5-methylsulfonylpyridine has a molecular weight of 187.22 g/mol, XLogP of 0.49, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-methylsulfonylpyridine is sourced from PubChem (CID 13433434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).