6-(dimethylamino)-1H-pyridine-2-thione

C7H10N2S — CID 23511094

IUPAC6-(dimethylamino)-1H-pyridine-2-thione
SMILESCN(C)c1cccc(=S)[nH]1
InChIInChI=1S/C7H10N2S/c1-9(2)6-4-3-5-7(10)8-6/h3-5H,1-2H3,(H,8,10)
InChIKeyKQHZYRAYEJYMKO-UHFFFAOYSA-N
MW154.24 g/mol
LogP1.81
Rot. Bonds1

About 6-(dimethylamino)-1H-pyridine-2-thione

6-(dimethylamino)-1H-pyridine-2-thione (PubChem CID 23511094) has the molecular formula C7H10N2S and a molecular weight of 154.24 g/mol. Its IUPAC name is 6-(dimethylamino)-1H-pyridine-2-thione.

Molecular Properties

Compound Name6-(dimethylamino)-1H-pyridine-2-thione
PubChem CID23511094
Molecular FormulaC7H10N2S
Molecular Weight154.24 g/mol
Exact Mass154.06
IUPAC Name6-(dimethylamino)-1H-pyridine-2-thione
SMILESCN(C)c1cccc(=S)[nH]1
InChIInChI=1S/C7H10N2S/c1-9(2)6-4-3-5-7(10)8-6/h3-5H,1-2H3,(H,8,10)
InChIKeyKQHZYRAYEJYMKO-UHFFFAOYSA-N
XLogP1.81
TPSA19.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.24
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

Analyze 6-(dimethylamino)-1H-pyridine-2-thione 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 6-(dimethylamino)-1H-pyridine-2-thione?
The IUPAC name of 6-(dimethylamino)-1H-pyridine-2-thione (CID 23511094) is 6-(dimethylamino)-1H-pyridine-2-thione.
What is the SMILES notation for 6-(dimethylamino)-1H-pyridine-2-thione?
The canonical SMILES for 6-(dimethylamino)-1H-pyridine-2-thione is CN(C)c1cccc(=S)[nH]1.
What is the InChIKey of 6-(dimethylamino)-1H-pyridine-2-thione?
The InChIKey is KQHZYRAYEJYMKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2S/c1-9(2)6-4-3-5-7(10)8-6/h3-5H,1-2H3,(H,8,10).
What are the key properties of 6-(dimethylamino)-1H-pyridine-2-thione?
6-(dimethylamino)-1H-pyridine-2-thione has a molecular weight of 154.24 g/mol, XLogP of 1.81, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(dimethylamino)-1H-pyridine-2-thione is sourced from PubChem (CID 23511094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).