3-methylsulfanyl-5-propan-2-yloxypyridine

C9H13NOS — CID 146035348

IUPAC3-methylsulfanyl-5-propan-2-yloxypyridine
SMILESCSc1cncc(OC(C)C)c1
InChIInChI=1S/C9H13NOS/c1-7(2)11-8-4-9(12-3)6-10-5-8/h4-7H,1-3H3
InChIKeyWLYRADUSGJTFQU-UHFFFAOYSA-N
MW183.28 g/mol
LogP2.59
Rot. Bonds3

About 3-methylsulfanyl-5-propan-2-yloxypyridine

3-methylsulfanyl-5-propan-2-yloxypyridine (PubChem CID 146035348) has the molecular formula C9H13NOS and a molecular weight of 183.28 g/mol. Its IUPAC name is 3-methylsulfanyl-5-propan-2-yloxypyridine.

Molecular Properties

Compound Name3-methylsulfanyl-5-propan-2-yloxypyridine
PubChem CID146035348
Molecular FormulaC9H13NOS
Molecular Weight183.28 g/mol
Exact Mass183.07
IUPAC Name3-methylsulfanyl-5-propan-2-yloxypyridine
SMILESCSc1cncc(OC(C)C)c1
InChIInChI=1S/C9H13NOS/c1-7(2)11-8-4-9(12-3)6-10-5-8/h4-7H,1-3H3
InChIKeyWLYRADUSGJTFQU-UHFFFAOYSA-N
XLogP2.59
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.28
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-aminosulfanyl-N-(5-propan-2-yloxy-3-pyridinyl)hydroxylamine
CID 146416991
3-bromo-5-propan-2-yloxypyridine;5-propan-2-yloxypyridin-3-amine
CID 158462322
[(2-methylsulfanylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
CID 105330517
trichloro-(4-propan-2-yloxyphenyl)silane
CID 69462595
1-(5-propan-2-yloxy-3-pyridinyl)prop-2-en-1-one
CID 103453607
(5-methylfuran-3-yl)-(5-propan-2-yloxy-3-pyridinyl)methanone
CID 115794614
N-methyl-3-(5-propan-2-yloxy-3-pyridinyl)prop-2-yn-1-amine
CID 114497986
(3-fluoro-4-methoxyphenyl)-(5-propan-2-yloxy-3-pyridinyl)methanone
CID 115794555
[2,2-dimethoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethyl]hydrazine
CID 105246133
4-(5-propan-2-yloxy-3-pyridinyl)cyclohexan-1-one
CID 83261333
(2-bromo-3-fluorophenyl)-(5-propan-2-yloxy-3-pyridinyl)methanone
CID 115794634
S-(5-methoxy-3-pyridinyl)thiohydroxylamine
CID 134532168

Frequently Asked Questions

What is the IUPAC name of 3-methylsulfanyl-5-propan-2-yloxypyridine?
The IUPAC name of 3-methylsulfanyl-5-propan-2-yloxypyridine (CID 146035348) is 3-methylsulfanyl-5-propan-2-yloxypyridine.
What is the SMILES notation for 3-methylsulfanyl-5-propan-2-yloxypyridine?
The canonical SMILES for 3-methylsulfanyl-5-propan-2-yloxypyridine is CSc1cncc(OC(C)C)c1.
What is the InChIKey of 3-methylsulfanyl-5-propan-2-yloxypyridine?
The InChIKey is WLYRADUSGJTFQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NOS/c1-7(2)11-8-4-9(12-3)6-10-5-8/h4-7H,1-3H3.
What are the key properties of 3-methylsulfanyl-5-propan-2-yloxypyridine?
3-methylsulfanyl-5-propan-2-yloxypyridine has a molecular weight of 183.28 g/mol, XLogP of 2.59, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylsulfanyl-5-propan-2-yloxypyridine is sourced from PubChem (CID 146035348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).