6-methyl-3,4-dihydro-2H-thiopyrano[2,3-c]pyridine 1,1-dioxide

C9H11NO2S — CID 58168659

IUPAC6-methyl-3,4-dihydro-2H-thiopyrano[2,3-c]pyridine 1,1-dioxide
SMILESCc1cc2c(cn1)S(=O)(=O)CCC2
InChIInChI=1S/C9H11NO2S/c1-7-5-8-3-2-4-13(11,12)9(8)6-10-7/h5-6H,2-4H2,1H3
InChIKeyFQARVWVOBWJZMP-UHFFFAOYSA-N
MW197.26 g/mol
LogP1.11
Rot. Bonds

About 6-methyl-3,4-dihydro-2H-thiopyrano[2,3-c]pyridine 1,1-dioxide

6-methyl-3,4-dihydro-2H-thiopyrano[2,3-c]pyridine 1,1-dioxide (PubChem CID 58168659) has the molecular formula C9H11NO2S and a molecular weight of 197.26 g/mol. Its IUPAC name is 6-methyl-3,4-dihydro-2H-thiopyrano[2,3-c]pyridine 1,1-dioxide.

Molecular Properties

Compound Name6-methyl-3,4-dihydro-2H-thiopyrano[2,3-c]pyridine 1,1-dioxide
PubChem CID58168659
Molecular FormulaC9H11NO2S
Molecular Weight197.26 g/mol
Exact Mass197.05
IUPAC Name6-methyl-3,4-dihydro-2H-thiopyrano[2,3-c]pyridine 1,1-dioxide
SMILESCc1cc2c(cn1)S(=O)(=O)CCC2
InChIInChI=1S/C9H11NO2S/c1-7-5-8-3-2-4-13(11,12)9(8)6-10-7/h5-6H,2-4H2,1H3
InChIKeyFQARVWVOBWJZMP-UHFFFAOYSA-N
XLogP1.11
TPSA47.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.26
LogP ≤ 51.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-3,4-dihydro-2H-thiopyrano[2,3-c]pyridine 1,1-dioxide?
The IUPAC name of 6-methyl-3,4-dihydro-2H-thiopyrano[2,3-c]pyridine 1,1-dioxide (CID 58168659) is 6-methyl-3,4-dihydro-2H-thiopyrano[2,3-c]pyridine 1,1-dioxide.
What is the SMILES notation for 6-methyl-3,4-dihydro-2H-thiopyrano[2,3-c]pyridine 1,1-dioxide?
The canonical SMILES for 6-methyl-3,4-dihydro-2H-thiopyrano[2,3-c]pyridine 1,1-dioxide is Cc1cc2c(cn1)S(=O)(=O)CCC2.
What is the InChIKey of 6-methyl-3,4-dihydro-2H-thiopyrano[2,3-c]pyridine 1,1-dioxide?
The InChIKey is FQARVWVOBWJZMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO2S/c1-7-5-8-3-2-4-13(11,12)9(8)6-10-7/h5-6H,2-4H2,1H3.
What are the key properties of 6-methyl-3,4-dihydro-2H-thiopyrano[2,3-c]pyridine 1,1-dioxide?
6-methyl-3,4-dihydro-2H-thiopyrano[2,3-c]pyridine 1,1-dioxide has a molecular weight of 197.26 g/mol, XLogP of 1.11, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3,4-dihydro-2H-thiopyrano[2,3-c]pyridine 1,1-dioxide is sourced from PubChem (CID 58168659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).