8-methyl-7,8-dihydro-5H-thiopyrano[4,3-b]pyridine 6-oxide

C9H11NOS — CID 130251279

IUPAC8-methyl-7,8-dihydro-5H-thiopyrano[4,3-b]pyridine 6-oxide
SMILESCC1CS(=O)Cc2cccnc21
InChIInChI=1S/C9H11NOS/c1-7-5-12(11)6-8-3-2-4-10-9(7)8/h2-4,7H,5-6H2,1H3
InChIKeyYHBAHTMVWQQOND-UHFFFAOYSA-N
MW181.26 g/mol
LogP1.45
Rot. Bonds

About 8-methyl-7,8-dihydro-5H-thiopyrano[4,3-b]pyridine 6-oxide

8-methyl-7,8-dihydro-5H-thiopyrano[4,3-b]pyridine 6-oxide (PubChem CID 130251279) has the molecular formula C9H11NOS and a molecular weight of 181.26 g/mol. Its IUPAC name is 8-methyl-7,8-dihydro-5H-thiopyrano[4,3-b]pyridine 6-oxide.

Molecular Properties

Compound Name8-methyl-7,8-dihydro-5H-thiopyrano[4,3-b]pyridine 6-oxide
PubChem CID130251279
Molecular FormulaC9H11NOS
Molecular Weight181.26 g/mol
Exact Mass181.06
IUPAC Name8-methyl-7,8-dihydro-5H-thiopyrano[4,3-b]pyridine 6-oxide
SMILESCC1CS(=O)Cc2cccnc21
InChIInChI=1S/C9H11NOS/c1-7-5-12(11)6-8-3-2-4-10-9(7)8/h2-4,7H,5-6H2,1H3
InChIKeyYHBAHTMVWQQOND-UHFFFAOYSA-N
XLogP1.45
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.26
LogP ≤ 51.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 8-methyl-7,8-dihydro-5H-thiopyrano[4,3-b]pyridine 6-oxide with MolForge

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Related Compounds

(8R)-8-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine
CID 86311748
7-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine;propane
CID 144513567
6,8-dimethyl-5,8-dihydro-1,6-naphthyridin-7-one
CID 142177840
(7S)-6,7-diethyl-6,7-dihydro-5H-cyclopenta[b]pyridine
CID 89333129
6-tert-butyl-7-ethyl-6,7-dihydro-5H-cyclopenta[b]pyridine
CID 71155361
8-propan-2-yl-7,8-dihydro-5H-quinolin-6-one
CID 160543917
2-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-one
CID 115783784
6,6-dimethyl-5,7-dihydrocyclopenta[b]pyridin-7-amine
CID 112714214
ethane;6-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine
CID 90875415
(8S)-5,5-difluoro-8-methyl-7,8-dihydro-6H-quinoline
CID 138501498
trimethyl(5,6,7,8-tetrahydroquinolin-8-yl)silane
CID 130535889
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine
CID 105009602

Frequently Asked Questions

What is the IUPAC name of 8-methyl-7,8-dihydro-5H-thiopyrano[4,3-b]pyridine 6-oxide?
The IUPAC name of 8-methyl-7,8-dihydro-5H-thiopyrano[4,3-b]pyridine 6-oxide (CID 130251279) is 8-methyl-7,8-dihydro-5H-thiopyrano[4,3-b]pyridine 6-oxide.
What is the SMILES notation for 8-methyl-7,8-dihydro-5H-thiopyrano[4,3-b]pyridine 6-oxide?
The canonical SMILES for 8-methyl-7,8-dihydro-5H-thiopyrano[4,3-b]pyridine 6-oxide is CC1CS(=O)Cc2cccnc21.
What is the InChIKey of 8-methyl-7,8-dihydro-5H-thiopyrano[4,3-b]pyridine 6-oxide?
The InChIKey is YHBAHTMVWQQOND-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NOS/c1-7-5-12(11)6-8-3-2-4-10-9(7)8/h2-4,7H,5-6H2,1H3.
What are the key properties of 8-methyl-7,8-dihydro-5H-thiopyrano[4,3-b]pyridine 6-oxide?
8-methyl-7,8-dihydro-5H-thiopyrano[4,3-b]pyridine 6-oxide has a molecular weight of 181.26 g/mol, XLogP of 1.45, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-7,8-dihydro-5H-thiopyrano[4,3-b]pyridine 6-oxide is sourced from PubChem (CID 130251279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).