3-methyl-2-methylimino-1,3-thiazolidine-4-thione

C5H8N2S2 — CID 45118439

IUPAC3-methyl-2-methylimino-1,3-thiazolidine-4-thione
SMILESC/N=C1\SCC(=S)N1C
InChIInChI=1S/C5H8N2S2/c1-6-5-7(2)4(8)3-9-5/h3H2,1-2H3/b6-5-
InChIKeyMFSDWYTXWQVBCO-WAYWQWQTSA-N
MW160.27 g/mol
LogP0.98
Rot. Bonds

About 3-methyl-2-methylimino-1,3-thiazolidine-4-thione

3-methyl-2-methylimino-1,3-thiazolidine-4-thione (PubChem CID 45118439) has the molecular formula C5H8N2S2 and a molecular weight of 160.27 g/mol. Its IUPAC name is 3-methyl-2-methylimino-1,3-thiazolidine-4-thione.

Molecular Properties

Compound Name3-methyl-2-methylimino-1,3-thiazolidine-4-thione
PubChem CID45118439
Molecular FormulaC5H8N2S2
Molecular Weight160.27 g/mol
Exact Mass160.01
IUPAC Name3-methyl-2-methylimino-1,3-thiazolidine-4-thione
SMILESC/N=C1\SCC(=S)N1C
InChIInChI=1S/C5H8N2S2/c1-6-5-7(2)4(8)3-9-5/h3H2,1-2H3/b6-5-
InChIKeyMFSDWYTXWQVBCO-WAYWQWQTSA-N
XLogP0.98
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.27
LogP ≤ 50.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

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Related Compounds

N,3-dimethyl-1,3-thiazolidin-2-imine;hydroiodide
CID 90654236
2-(dimethylamino)-6,7-dihydro-4H-[1,3]thiazolo[3,2-a][1,3,5]triazine-4-thione
CID 658365
2-Thiazolidinethione, 3-(4,5-dihydro-2-thiazolyl)-
CID 11356179
N,3-dimethyl-1,3-thiazolidin-2-imine
CID 13914821
2-Methylimino-3,5-dimethylthiazolidine
CID 12718849
Cyanamide, (3-ethyl-2-thiazolidinylidene)-
CID 10888137
Cyanamide, (3-methyl-2-thiazolidinylidene)-
CID 11105461
1-ethyl-2-ethylsulfanyl-4H-imidazole-5-thione
CID 22097466
N,N-dimethyl-1-[(3-methyl-1,3-thiazolidin-2-ylidene)amino]methanamine
CID 54185934
N,N-dimethyl-1-[(Z)-(3-methyl-1,3-thiazolidin-2-ylidene)amino]methanamine
CID 88784166
N,N-dimethyl-N'-(4-sulfanylidene-1,3-thiazol-2-yl)methanimidamide
CID 146952875
(3,5-Dimethyl-1,3-thiazolidin-2-ylidene)-dimethylazanium
CID 12718861

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-methylimino-1,3-thiazolidine-4-thione?
The IUPAC name of 3-methyl-2-methylimino-1,3-thiazolidine-4-thione (CID 45118439) is 3-methyl-2-methylimino-1,3-thiazolidine-4-thione.
What is the SMILES notation for 3-methyl-2-methylimino-1,3-thiazolidine-4-thione?
The canonical SMILES for 3-methyl-2-methylimino-1,3-thiazolidine-4-thione is C/N=C1\SCC(=S)N1C.
What is the InChIKey of 3-methyl-2-methylimino-1,3-thiazolidine-4-thione?
The InChIKey is MFSDWYTXWQVBCO-WAYWQWQTSA-N. The full InChI is InChI=1S/C5H8N2S2/c1-6-5-7(2)4(8)3-9-5/h3H2,1-2H3/b6-5-.
What are the key properties of 3-methyl-2-methylimino-1,3-thiazolidine-4-thione?
3-methyl-2-methylimino-1,3-thiazolidine-4-thione has a molecular weight of 160.27 g/mol, XLogP of 0.98, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-methylimino-1,3-thiazolidine-4-thione is sourced from PubChem (CID 45118439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).