2-methyl-3-methylsulfanylpyridine;propane

C10H17NS — CID 142465096

IUPAC2-methyl-3-methylsulfanylpyridine;propane
SMILESCCC.CSc1cccnc1C
InChIInChI=1S/C7H9NS.C3H8/c1-6-7(9-2)4-3-5-8-6;1-3-2/h3-5H,1-2H3;3H2,1-2H3
InChIKeyVDAYWOJPWVJWLQ-UHFFFAOYSA-N
MW183.32 g/mol
LogP3.53
Rot. Bonds1

About 2-methyl-3-methylsulfanylpyridine;propane

2-methyl-3-methylsulfanylpyridine;propane (PubChem CID 142465096) has the molecular formula C10H17NS and a molecular weight of 183.32 g/mol. Its IUPAC name is 2-methyl-3-methylsulfanylpyridine;propane.

Molecular Properties

Compound Name2-methyl-3-methylsulfanylpyridine;propane
PubChem CID142465096
Molecular FormulaC10H17NS
Molecular Weight183.32 g/mol
Exact Mass183.11
IUPAC Name2-methyl-3-methylsulfanylpyridine;propane
SMILESCCC.CSc1cccnc1C
InChIInChI=1S/C7H9NS.C3H8/c1-6-7(9-2)4-3-5-8-6;1-3-2/h3-5H,1-2H3;3H2,1-2H3
InChIKeyVDAYWOJPWVJWLQ-UHFFFAOYSA-N
XLogP3.53
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.32
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-methyl-3-methylsulfanylpyridine;propane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-methylsulfanylpyridine;propane?
The IUPAC name of 2-methyl-3-methylsulfanylpyridine;propane (CID 142465096) is 2-methyl-3-methylsulfanylpyridine;propane.
What is the SMILES notation for 2-methyl-3-methylsulfanylpyridine;propane?
The canonical SMILES for 2-methyl-3-methylsulfanylpyridine;propane is CCC.CSc1cccnc1C.
What is the InChIKey of 2-methyl-3-methylsulfanylpyridine;propane?
The InChIKey is VDAYWOJPWVJWLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NS.C3H8/c1-6-7(9-2)4-3-5-8-6;1-3-2/h3-5H,1-2H3;3H2,1-2H3.
What are the key properties of 2-methyl-3-methylsulfanylpyridine;propane?
2-methyl-3-methylsulfanylpyridine;propane has a molecular weight of 183.32 g/mol, XLogP of 3.53, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-methylsulfanylpyridine;propane is sourced from PubChem (CID 142465096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).