5-ethenyl-1-imino-4-methyl-1,3-thiazole

C6H8N2S — CID 142634974

IUPAC5-ethenyl-1-imino-4-methyl-1,3-thiazole
SMILES[H]/N=S1\C=NC(C)=C1C=C
InChIInChI=1S/C6H8N2S/c1-3-6-5(2)8-4-9(6)7/h3-4,7H,1H2,2H3
InChIKeyDZJQEYBOBKIJQV-UHFFFAOYSA-N
MW140.21 g/mol
LogP1.83
Rot. Bonds1

About 5-ethenyl-1-imino-4-methyl-1,3-thiazole

5-ethenyl-1-imino-4-methyl-1,3-thiazole (PubChem CID 142634974) has the molecular formula C6H8N2S and a molecular weight of 140.21 g/mol. Its IUPAC name is 5-ethenyl-1-imino-4-methyl-1,3-thiazole.

Molecular Properties

Compound Name5-ethenyl-1-imino-4-methyl-1,3-thiazole
PubChem CID142634974
Molecular FormulaC6H8N2S
Molecular Weight140.21 g/mol
Exact Mass140.04
IUPAC Name5-ethenyl-1-imino-4-methyl-1,3-thiazole
SMILES[H]/N=S1\C=NC(C)=C1C=C
InChIInChI=1S/C6H8N2S/c1-3-6-5(2)8-4-9(6)7/h3-4,7H,1H2,2H3
InChIKeyDZJQEYBOBKIJQV-UHFFFAOYSA-N
XLogP1.83
TPSA36.21 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.21
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4,5-Di(ethylidene)-1,3-thiazole
CID 90767189
N-methyl-4-prop-2-enylidene-1,3-thiazol-5-imine
CID 91101949
(4E,5E)-4,5-di(ethylidene)-1,3-thiazole
CID 130239694
(4E)-N-methyl-4-prop-2-enylidene-1,3-thiazol-5-imine
CID 139417005

Frequently Asked Questions

What is the IUPAC name of 5-ethenyl-1-imino-4-methyl-1,3-thiazole?
The IUPAC name of 5-ethenyl-1-imino-4-methyl-1,3-thiazole (CID 142634974) is 5-ethenyl-1-imino-4-methyl-1,3-thiazole.
What is the SMILES notation for 5-ethenyl-1-imino-4-methyl-1,3-thiazole?
The canonical SMILES for 5-ethenyl-1-imino-4-methyl-1,3-thiazole is [H]/N=S1\C=NC(C)=C1C=C.
What is the InChIKey of 5-ethenyl-1-imino-4-methyl-1,3-thiazole?
The InChIKey is DZJQEYBOBKIJQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2S/c1-3-6-5(2)8-4-9(6)7/h3-4,7H,1H2,2H3.
What are the key properties of 5-ethenyl-1-imino-4-methyl-1,3-thiazole?
5-ethenyl-1-imino-4-methyl-1,3-thiazole has a molecular weight of 140.21 g/mol, XLogP of 1.83, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-1-imino-4-methyl-1,3-thiazole is sourced from PubChem (CID 142634974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).