1-methyl-3-methylsulfanylpiperidine

C7H15NS — CID 15063099

IUPAC1-methyl-3-methylsulfanylpiperidine
SMILESCSC1CCCN(C)C1
InChIInChI=1S/C7H15NS/c1-8-5-3-4-7(6-8)9-2/h7H,3-6H2,1-2H3
InChIKeyWIPAAZZSPWASRN-UHFFFAOYSA-N
MW145.27 g/mol
LogP1.44
Rot. Bonds1

About 1-methyl-3-methylsulfanylpiperidine

1-methyl-3-methylsulfanylpiperidine (PubChem CID 15063099) has the molecular formula C7H15NS and a molecular weight of 145.27 g/mol. Its IUPAC name is 1-methyl-3-methylsulfanylpiperidine.

Molecular Properties

Compound Name1-methyl-3-methylsulfanylpiperidine
PubChem CID15063099
Molecular FormulaC7H15NS
Molecular Weight145.27 g/mol
Exact Mass145.09
IUPAC Name1-methyl-3-methylsulfanylpiperidine
SMILESCSC1CCCN(C)C1
InChIInChI=1S/C7H15NS/c1-8-5-3-4-7(6-8)9-2/h7H,3-6H2,1-2H3
InChIKeyWIPAAZZSPWASRN-UHFFFAOYSA-N
XLogP1.44
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.27
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-methyl-3-methylsulfanylpiperidine 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 1-methyl-3-methylsulfanylpiperidine?
The IUPAC name of 1-methyl-3-methylsulfanylpiperidine (CID 15063099) is 1-methyl-3-methylsulfanylpiperidine.
What is the SMILES notation for 1-methyl-3-methylsulfanylpiperidine?
The canonical SMILES for 1-methyl-3-methylsulfanylpiperidine is CSC1CCCN(C)C1.
What is the InChIKey of 1-methyl-3-methylsulfanylpiperidine?
The InChIKey is WIPAAZZSPWASRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NS/c1-8-5-3-4-7(6-8)9-2/h7H,3-6H2,1-2H3.
What are the key properties of 1-methyl-3-methylsulfanylpiperidine?
1-methyl-3-methylsulfanylpiperidine has a molecular weight of 145.27 g/mol, XLogP of 1.44, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-methylsulfanylpiperidine is sourced from PubChem (CID 15063099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).