N-methyl-2-(3-methylsulfanylanilino)acetamide

C10H14N2OS — CID 28568297

IUPACN-methyl-2-(3-methylsulfanylanilino)acetamide
SMILESCNC(=O)CNc1cccc(SC)c1
InChIInChI=1S/C10H14N2OS/c1-11-10(13)7-12-8-4-3-5-9(6-8)14-2/h3-6,12H,7H2,1-2H3,(H,11,13)
InChIKeyWRDYXLCLODACJH-UHFFFAOYSA-N
MW210.30 g/mol
LogP1.57
Rot. Bonds4

About N-methyl-2-(3-methylsulfanylanilino)acetamide

N-methyl-2-(3-methylsulfanylanilino)acetamide (PubChem CID 28568297) has the molecular formula C10H14N2OS and a molecular weight of 210.30 g/mol. Its IUPAC name is N-methyl-2-(3-methylsulfanylanilino)acetamide.

Molecular Properties

Compound NameN-methyl-2-(3-methylsulfanylanilino)acetamide
PubChem CID28568297
Molecular FormulaC10H14N2OS
Molecular Weight210.30 g/mol
Exact Mass210.08
IUPAC NameN-methyl-2-(3-methylsulfanylanilino)acetamide
SMILESCNC(=O)CNc1cccc(SC)c1
InChIInChI=1S/C10H14N2OS/c1-11-10(13)7-12-8-4-3-5-9(6-8)14-2/h3-6,12H,7H2,1-2H3,(H,11,13)
InChIKeyWRDYXLCLODACJH-UHFFFAOYSA-N
XLogP1.57
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.30
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-3-(3-methylsulfanylanilino)propanamide
CID 62324761
N-(2-methylidenebutyl)-3-methylsulfanylaniline
CID 66047338
2-[3-(aminomethyl)anilino]-N-methylacetamide
CID 144916665
N-methyl-4-[(3-methylsulfanylanilino)methyl]benzamide
CID 60961432
N-[(E)-3-chloro-2-methylprop-2-enyl]-3-methylsulfanylaniline
CID 106437281
N-(3-methylsulfanylphenyl)-2-sulfanylacetamide
CID 54336720
N-cyclopropyl-N-ethyl-2-(3-methylsulfanylanilino)acetamide
CID 54956869
3-(3-methylsulfanylanilino)propane-1,2-diol
CID 76891537
2-methyl-2-(methylamino)-N-(3-methylsulfanylphenyl)propanamide
CID 62834107
2-isocyano-N-(3-methylsulfanylphenyl)acetamide
CID 108814742
N-methyl-2-[3-(trifluoromethoxy)anilino]acetamide
CID 28586079
methyl 4-(3-methylsulfanylanilino)butanoate
CID 43377793

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(3-methylsulfanylanilino)acetamide?
The IUPAC name of N-methyl-2-(3-methylsulfanylanilino)acetamide (CID 28568297) is N-methyl-2-(3-methylsulfanylanilino)acetamide.
What is the SMILES notation for N-methyl-2-(3-methylsulfanylanilino)acetamide?
The canonical SMILES for N-methyl-2-(3-methylsulfanylanilino)acetamide is CNC(=O)CNc1cccc(SC)c1.
What is the InChIKey of N-methyl-2-(3-methylsulfanylanilino)acetamide?
The InChIKey is WRDYXLCLODACJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2OS/c1-11-10(13)7-12-8-4-3-5-9(6-8)14-2/h3-6,12H,7H2,1-2H3,(H,11,13).
What are the key properties of N-methyl-2-(3-methylsulfanylanilino)acetamide?
N-methyl-2-(3-methylsulfanylanilino)acetamide has a molecular weight of 210.30 g/mol, XLogP of 1.57, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(3-methylsulfanylanilino)acetamide is sourced from PubChem (CID 28568297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).