N-methyl-2-pyrimidin-2-ylsulfanylacetamide

C7H9N3OS — CID 21061194

IUPACN-methyl-2-pyrimidin-2-ylsulfanylacetamide
SMILESCNC(=O)CSc1ncccn1
InChIInChI=1S/C7H9N3OS/c1-8-6(11)5-12-7-9-3-2-4-10-7/h2-4H,5H2,1H3,(H,8,11)
InChIKeyNYDZMCYRIBQOJY-UHFFFAOYSA-N
MW183.24 g/mol
LogP0.31
Rot. Bonds3

About N-methyl-2-pyrimidin-2-ylsulfanylacetamide

N-methyl-2-pyrimidin-2-ylsulfanylacetamide (PubChem CID 21061194) has the molecular formula C7H9N3OS and a molecular weight of 183.24 g/mol. Its IUPAC name is N-methyl-2-pyrimidin-2-ylsulfanylacetamide.

Molecular Properties

Compound NameN-methyl-2-pyrimidin-2-ylsulfanylacetamide
PubChem CID21061194
Molecular FormulaC7H9N3OS
Molecular Weight183.24 g/mol
Exact Mass183.05
IUPAC NameN-methyl-2-pyrimidin-2-ylsulfanylacetamide
SMILESCNC(=O)CSc1ncccn1
InChIInChI=1S/C7H9N3OS/c1-8-6(11)5-12-7-9-3-2-4-10-7/h2-4H,5H2,1H3,(H,8,11)
InChIKeyNYDZMCYRIBQOJY-UHFFFAOYSA-N
XLogP0.31
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.24
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-2-pyrimidin-2-ylsulfanylacetamide 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-ethyl-2-pyrimidin-2-ylsulfanylacetamide
CID 39082382
N-methyl-2-[(3-methyl-2-pyridinyl)sulfanyl]acetamide
CID 130638391
N,N-dimethyl-2-[(2-pyrimidin-2-ylsulfanylacetyl)amino]acetamide
CID 9202418
N-[2-(dimethylamino)ethyl]-2-pyrimidin-2-ylsulfanylacetamide
CID 39082404
N-(2-methoxyethylcarbamoyl)-2-pyrimidin-2-ylsulfanylacetamide
CID 2651102
N-[4-(pyridin-4-ylmethyl)phenyl]-2-pyrimidin-2-ylsulfanylacetamide
CID 5199579
2-pyrimidin-2-ylsulfanyl-N-(3,4,5-trimethoxyphenyl)acetamide
CID 2592805
(2S)-2-amino-3-[(2-pyrimidin-2-ylsulfanylacetyl)amino]propanoic acid
CID 70134863
N-(2-phenylethyl)-2-pyrimidin-2-ylsulfanylacetamide
CID 846435
2-(6-chloropyrimidin-4-yl)sulfanyl-N-methylacetamide
CID 130489954
2-pyrimidin-2-ylsulfanyl-1-[4-(2-pyrimidin-2-ylsulfanylacetyl)piperazin-1-yl]ethanone
CID 1239284
propan-2-yl 2-pyrimidin-2-ylsulfanylacetate
CID 47095344

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-pyrimidin-2-ylsulfanylacetamide?
The IUPAC name of N-methyl-2-pyrimidin-2-ylsulfanylacetamide (CID 21061194) is N-methyl-2-pyrimidin-2-ylsulfanylacetamide.
What is the SMILES notation for N-methyl-2-pyrimidin-2-ylsulfanylacetamide?
The canonical SMILES for N-methyl-2-pyrimidin-2-ylsulfanylacetamide is CNC(=O)CSc1ncccn1.
What is the InChIKey of N-methyl-2-pyrimidin-2-ylsulfanylacetamide?
The InChIKey is NYDZMCYRIBQOJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3OS/c1-8-6(11)5-12-7-9-3-2-4-10-7/h2-4H,5H2,1H3,(H,8,11).
What are the key properties of N-methyl-2-pyrimidin-2-ylsulfanylacetamide?
N-methyl-2-pyrimidin-2-ylsulfanylacetamide has a molecular weight of 183.24 g/mol, XLogP of 0.31, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-pyrimidin-2-ylsulfanylacetamide is sourced from PubChem (CID 21061194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).