3-methyl-2-methylidene-5-methylsulfanylpyrrolidine

C7H13NS — CID 167287557

IUPAC3-methyl-2-methylidene-5-methylsulfanylpyrrolidine
SMILESC=C1NC(SC)CC1C
InChIInChI=1S/C7H13NS/c1-5-4-7(9-3)8-6(5)2/h5,7-8H,2,4H2,1,3H3
InChIKeyCNUAQQUNNLZUBV-UHFFFAOYSA-N
MW143.25 g/mol
LogP1.82
Rot. Bonds1

About 3-methyl-2-methylidene-5-methylsulfanylpyrrolidine

3-methyl-2-methylidene-5-methylsulfanylpyrrolidine (PubChem CID 167287557) has the molecular formula C7H13NS and a molecular weight of 143.25 g/mol. Its IUPAC name is 3-methyl-2-methylidene-5-methylsulfanylpyrrolidine.

Molecular Properties

Compound Name3-methyl-2-methylidene-5-methylsulfanylpyrrolidine
PubChem CID167287557
Molecular FormulaC7H13NS
Molecular Weight143.25 g/mol
Exact Mass143.08
IUPAC Name3-methyl-2-methylidene-5-methylsulfanylpyrrolidine
SMILESC=C1NC(SC)CC1C
InChIInChI=1S/C7H13NS/c1-5-4-7(9-3)8-6(5)2/h5,7-8H,2,4H2,1,3H3
InChIKeyCNUAQQUNNLZUBV-UHFFFAOYSA-N
XLogP1.82
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.25
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-methyl-2-methylidene-5-methylsulfanylpyrrolidine 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 3-methyl-2-methylidene-5-methylsulfanylpyrrolidine?
The IUPAC name of 3-methyl-2-methylidene-5-methylsulfanylpyrrolidine (CID 167287557) is 3-methyl-2-methylidene-5-methylsulfanylpyrrolidine.
What is the SMILES notation for 3-methyl-2-methylidene-5-methylsulfanylpyrrolidine?
The canonical SMILES for 3-methyl-2-methylidene-5-methylsulfanylpyrrolidine is C=C1NC(SC)CC1C.
What is the InChIKey of 3-methyl-2-methylidene-5-methylsulfanylpyrrolidine?
The InChIKey is CNUAQQUNNLZUBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NS/c1-5-4-7(9-3)8-6(5)2/h5,7-8H,2,4H2,1,3H3.
What are the key properties of 3-methyl-2-methylidene-5-methylsulfanylpyrrolidine?
3-methyl-2-methylidene-5-methylsulfanylpyrrolidine has a molecular weight of 143.25 g/mol, XLogP of 1.82, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-methylidene-5-methylsulfanylpyrrolidine is sourced from PubChem (CID 167287557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).