N-ethyl-N-methyl-2-(4-methylsulfanylanilino)acetamide

C12H18N2OS — CID 43309578

IUPACN-ethyl-N-methyl-2-(4-methylsulfanylanilino)acetamide
SMILESCCN(C)C(=O)CNc1ccc(SC)cc1
InChIInChI=1S/C12H18N2OS/c1-4-14(2)12(15)9-13-10-5-7-11(16-3)8-6-10/h5-8,13H,4,9H2,1-3H3
InChIKeyWSXHLFVFLZCXBH-UHFFFAOYSA-N
MW238.36 g/mol
LogP2.30
Rot. Bonds5

About N-ethyl-N-methyl-2-(4-methylsulfanylanilino)acetamide

N-ethyl-N-methyl-2-(4-methylsulfanylanilino)acetamide (PubChem CID 43309578) has the molecular formula C12H18N2OS and a molecular weight of 238.36 g/mol. Its IUPAC name is N-ethyl-N-methyl-2-(4-methylsulfanylanilino)acetamide.

Molecular Properties

Compound NameN-ethyl-N-methyl-2-(4-methylsulfanylanilino)acetamide
PubChem CID43309578
Molecular FormulaC12H18N2OS
Molecular Weight238.36 g/mol
Exact Mass238.11
IUPAC NameN-ethyl-N-methyl-2-(4-methylsulfanylanilino)acetamide
SMILESCCN(C)C(=O)CNc1ccc(SC)cc1
InChIInChI=1S/C12H18N2OS/c1-4-14(2)12(15)9-13-10-5-7-11(16-3)8-6-10/h5-8,13H,4,9H2,1-3H3
InChIKeyWSXHLFVFLZCXBH-UHFFFAOYSA-N
XLogP2.30
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.36
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-ethyl-N-methyl-2-(4-methylsulfanylanilino)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-ethyl-2-(4-fluoroanilino)-N-methylacetamide
CID 43309636
N-ethyl-2-(4-ethylanilino)-N-methylacetamide
CID 43309649
2-[4-(dimethylamino)anilino]-N-ethyl-N-methylacetamide
CID 43617050
2-(3,4-diethoxyanilino)-N-ethyl-N-methylacetamide
CID 43309603
N-ethyl-2-(3-fluoro-4-methoxyanilino)-N-methylacetamide
CID 43380729
butyl 2-(4-methylsulfanylanilino)acetate
CID 54917733
N-ethyl-N-methyl-2-(4-methyl-3-nitroanilino)acetamide
CID 114133940
2-(3-bromo-4-carbamothioylanilino)-N-ethyl-N-methylacetamide
CID 114132816
N',N'-dimethyl-N-(4-methylsulfanylphenyl)propane-1,3-diamine
CID 114525043
N,N-diethyl-2-(4-hydroxyanilino)acetamide
CID 11806273
(2S)-1-(4-methylsulfanylanilino)propan-2-ol
CID 93345415
N-ethyl-N-methyl-2-(pyrimidin-2-ylamino)acetamide
CID 104925715

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-2-(4-methylsulfanylanilino)acetamide?
The IUPAC name of N-ethyl-N-methyl-2-(4-methylsulfanylanilino)acetamide (CID 43309578) is N-ethyl-N-methyl-2-(4-methylsulfanylanilino)acetamide.
What is the SMILES notation for N-ethyl-N-methyl-2-(4-methylsulfanylanilino)acetamide?
The canonical SMILES for N-ethyl-N-methyl-2-(4-methylsulfanylanilino)acetamide is CCN(C)C(=O)CNc1ccc(SC)cc1.
What is the InChIKey of N-ethyl-N-methyl-2-(4-methylsulfanylanilino)acetamide?
The InChIKey is WSXHLFVFLZCXBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2OS/c1-4-14(2)12(15)9-13-10-5-7-11(16-3)8-6-10/h5-8,13H,4,9H2,1-3H3.
What are the key properties of N-ethyl-N-methyl-2-(4-methylsulfanylanilino)acetamide?
N-ethyl-N-methyl-2-(4-methylsulfanylanilino)acetamide has a molecular weight of 238.36 g/mol, XLogP of 2.30, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-2-(4-methylsulfanylanilino)acetamide is sourced from PubChem (CID 43309578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).