2-(dimethylamino)-N-methyl-2-sulfanylideneacetamide

C5H10N2OS — CID 55288321

IUPAC2-(dimethylamino)-N-methyl-2-sulfanylideneacetamide
SMILESCNC(=O)C(=S)N(C)C
InChIInChI=1S/C5H10N2OS/c1-6-4(8)5(9)7(2)3/h1-3H3,(H,6,8)
InChIKeyITFLAKCTJKOXCH-UHFFFAOYSA-N
MW146.21 g/mol
LogP-0.38
Rot. Bonds

About 2-(dimethylamino)-N-methyl-2-sulfanylideneacetamide

2-(dimethylamino)-N-methyl-2-sulfanylideneacetamide (PubChem CID 55288321) has the molecular formula C5H10N2OS and a molecular weight of 146.21 g/mol. Its IUPAC name is 2-(dimethylamino)-N-methyl-2-sulfanylideneacetamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-methyl-2-sulfanylideneacetamide
PubChem CID55288321
Molecular FormulaC5H10N2OS
Molecular Weight146.21 g/mol
Exact Mass146.05
IUPAC Name2-(dimethylamino)-N-methyl-2-sulfanylideneacetamide
SMILESCNC(=O)C(=S)N(C)C
InChIInChI=1S/C5H10N2OS/c1-6-4(8)5(9)7(2)3/h1-3H3,(H,6,8)
InChIKeyITFLAKCTJKOXCH-UHFFFAOYSA-N
XLogP-0.38
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.21
LogP ≤ 5-0.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-(dimethylamino)-N-methyl-2-sulfanylideneacetamide 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-(dimethylamino)-N-methyl-2-sulfanylideneacetamide?
The IUPAC name of 2-(dimethylamino)-N-methyl-2-sulfanylideneacetamide (CID 55288321) is 2-(dimethylamino)-N-methyl-2-sulfanylideneacetamide.
What is the SMILES notation for 2-(dimethylamino)-N-methyl-2-sulfanylideneacetamide?
The canonical SMILES for 2-(dimethylamino)-N-methyl-2-sulfanylideneacetamide is CNC(=O)C(=S)N(C)C.
What is the InChIKey of 2-(dimethylamino)-N-methyl-2-sulfanylideneacetamide?
The InChIKey is ITFLAKCTJKOXCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2OS/c1-6-4(8)5(9)7(2)3/h1-3H3,(H,6,8).
What are the key properties of 2-(dimethylamino)-N-methyl-2-sulfanylideneacetamide?
2-(dimethylamino)-N-methyl-2-sulfanylideneacetamide has a molecular weight of 146.21 g/mol, XLogP of -0.38, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-methyl-2-sulfanylideneacetamide is sourced from PubChem (CID 55288321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).