2-methyl-N-(5-methylthiolan-3-yl)pyridin-3-amine

C11H16N2S — CID 79950690

IUPAC2-methyl-N-(5-methylthiolan-3-yl)pyridin-3-amine
SMILESCc1ncccc1NC1CSC(C)C1
InChIInChI=1S/C11H16N2S/c1-8-6-10(7-14-8)13-11-4-3-5-12-9(11)2/h3-5,8,10,13H,6-7H2,1-2H3
InChIKeyFYLZDQWJUBDGCP-UHFFFAOYSA-N
MW208.33 g/mol
LogP2.70
Rot. Bonds2

About 2-methyl-N-(5-methylthiolan-3-yl)pyridin-3-amine

2-methyl-N-(5-methylthiolan-3-yl)pyridin-3-amine (PubChem CID 79950690) has the molecular formula C11H16N2S and a molecular weight of 208.33 g/mol. Its IUPAC name is 2-methyl-N-(5-methylthiolan-3-yl)pyridin-3-amine.

Molecular Properties

Compound Name2-methyl-N-(5-methylthiolan-3-yl)pyridin-3-amine
PubChem CID79950690
Molecular FormulaC11H16N2S
Molecular Weight208.33 g/mol
Exact Mass208.10
IUPAC Name2-methyl-N-(5-methylthiolan-3-yl)pyridin-3-amine
SMILESCc1ncccc1NC1CSC(C)C1
InChIInChI=1S/C11H16N2S/c1-8-6-10(7-14-8)13-11-4-3-5-12-9(11)2/h3-5,8,10,13H,6-7H2,1-2H3
InChIKeyFYLZDQWJUBDGCP-UHFFFAOYSA-N
XLogP2.70
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.33
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-methyl-N-(5-methylthiolan-3-yl)pyridin-3-amine 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-N-(5-methylthiolan-3-yl)pyridin-3-amine?
The IUPAC name of 2-methyl-N-(5-methylthiolan-3-yl)pyridin-3-amine (CID 79950690) is 2-methyl-N-(5-methylthiolan-3-yl)pyridin-3-amine.
What is the SMILES notation for 2-methyl-N-(5-methylthiolan-3-yl)pyridin-3-amine?
The canonical SMILES for 2-methyl-N-(5-methylthiolan-3-yl)pyridin-3-amine is Cc1ncccc1NC1CSC(C)C1.
What is the InChIKey of 2-methyl-N-(5-methylthiolan-3-yl)pyridin-3-amine?
The InChIKey is FYLZDQWJUBDGCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2S/c1-8-6-10(7-14-8)13-11-4-3-5-12-9(11)2/h3-5,8,10,13H,6-7H2,1-2H3.
What are the key properties of 2-methyl-N-(5-methylthiolan-3-yl)pyridin-3-amine?
2-methyl-N-(5-methylthiolan-3-yl)pyridin-3-amine has a molecular weight of 208.33 g/mol, XLogP of 2.70, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(5-methylthiolan-3-yl)pyridin-3-amine is sourced from PubChem (CID 79950690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).