N-methyl-2-[(3-methyl-2-pyridinyl)sulfanyl]acetamide

C9H12N2OS — CID 130638391

IUPACN-methyl-2-[(3-methyl-2-pyridinyl)sulfanyl]acetamide
SMILESCNC(=O)CSc1ncccc1C
InChIInChI=1S/C9H12N2OS/c1-7-4-3-5-11-9(7)13-6-8(12)10-2/h3-5H,6H2,1-2H3,(H,10,12)
InChIKeyJNKXEFIINHYAQZ-UHFFFAOYSA-N
MW196.27 g/mol
LogP1.23
Rot. Bonds3

About N-methyl-2-[(3-methyl-2-pyridinyl)sulfanyl]acetamide

N-methyl-2-[(3-methyl-2-pyridinyl)sulfanyl]acetamide (PubChem CID 130638391) has the molecular formula C9H12N2OS and a molecular weight of 196.27 g/mol. Its IUPAC name is N-methyl-2-[(3-methyl-2-pyridinyl)sulfanyl]acetamide.

Molecular Properties

Compound NameN-methyl-2-[(3-methyl-2-pyridinyl)sulfanyl]acetamide
PubChem CID130638391
Molecular FormulaC9H12N2OS
Molecular Weight196.27 g/mol
Exact Mass196.07
IUPAC NameN-methyl-2-[(3-methyl-2-pyridinyl)sulfanyl]acetamide
SMILESCNC(=O)CSc1ncccc1C
InChIInChI=1S/C9H12N2OS/c1-7-4-3-5-11-9(7)13-6-8(12)10-2/h3-5H,6H2,1-2H3,(H,10,12)
InChIKeyJNKXEFIINHYAQZ-UHFFFAOYSA-N
XLogP1.23
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.27
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-2-[(3-methyl-2-pyridinyl)sulfanyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-methyl-2-pyrimidin-2-ylsulfanylacetamide
CID 21061194
N-methyl-2-(3-methyl-2-pyridinyl)acetamide
CID 13400651
N-methoxy-2-[[2-[2-(methoxyamino)-2-oxoethyl]sulfanyl-3-pyridinyl]sulfanyl]acetamide
CID 90073674
2-[(3-chloro-2-pyridinyl)sulfanyl]-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 46693728
2-(2,2-difluoroethylsulfanyl)-3-methylpyridine
CID 131020461
2-[(3-chloro-2-pyridinyl)sulfanyl]-N-(2-methylpropyl)acetamide
CID 47138570
N-methyl-2-[[2-(propylamino)-3-pyridinyl]methylsulfanyl]acetamide
CID 114231922
2-[2-(butan-2-ylamino)-2-oxoethyl]sulfanylpyridine-3-carboxylic acid
CID 4130449
2-[(3-amino-2-pyridinyl)sulfanyl]-N-butan-2-ylacetamide
CID 43300815
2-[(3-amino-2-pyridinyl)sulfanyl]-N-phenylacetamide
CID 43300867
N-(2-methylphenyl)-2-pyridin-2-ylsulfanylacetamide
CID 7027156
methyl 3-[(3-methyl-2-pyridinyl)sulfanyl]-4-oxopentanoate
CID 155298465

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[(3-methyl-2-pyridinyl)sulfanyl]acetamide?
The IUPAC name of N-methyl-2-[(3-methyl-2-pyridinyl)sulfanyl]acetamide (CID 130638391) is N-methyl-2-[(3-methyl-2-pyridinyl)sulfanyl]acetamide.
What is the SMILES notation for N-methyl-2-[(3-methyl-2-pyridinyl)sulfanyl]acetamide?
The canonical SMILES for N-methyl-2-[(3-methyl-2-pyridinyl)sulfanyl]acetamide is CNC(=O)CSc1ncccc1C.
What is the InChIKey of N-methyl-2-[(3-methyl-2-pyridinyl)sulfanyl]acetamide?
The InChIKey is JNKXEFIINHYAQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2OS/c1-7-4-3-5-11-9(7)13-6-8(12)10-2/h3-5H,6H2,1-2H3,(H,10,12).
What are the key properties of N-methyl-2-[(3-methyl-2-pyridinyl)sulfanyl]acetamide?
N-methyl-2-[(3-methyl-2-pyridinyl)sulfanyl]acetamide has a molecular weight of 196.27 g/mol, XLogP of 1.23, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[(3-methyl-2-pyridinyl)sulfanyl]acetamide is sourced from PubChem (CID 130638391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).