5,6-bis(ethenyl)-3,4-dihydro-2H-1,3-thiazine

C8H11NS — CID 145093800

IUPAC5,6-bis(ethenyl)-3,4-dihydro-2H-1,3-thiazine
SMILESC=CC1=C(C=C)SCNC1
InChIInChI=1S/C8H11NS/c1-3-7-5-9-6-10-8(7)4-2/h3-4,9H,1-2,5-6H2
InChIKeyLDDKFRGIFQBPNG-UHFFFAOYSA-N
MW153.25 g/mol
LogP1.91
Rot. Bonds2

About 5,6-bis(ethenyl)-3,4-dihydro-2H-1,3-thiazine

5,6-bis(ethenyl)-3,4-dihydro-2H-1,3-thiazine (PubChem CID 145093800) has the molecular formula C8H11NS and a molecular weight of 153.25 g/mol. Its IUPAC name is 5,6-bis(ethenyl)-3,4-dihydro-2H-1,3-thiazine.

Molecular Properties

Compound Name5,6-bis(ethenyl)-3,4-dihydro-2H-1,3-thiazine
PubChem CID145093800
Molecular FormulaC8H11NS
Molecular Weight153.25 g/mol
Exact Mass153.06
IUPAC Name5,6-bis(ethenyl)-3,4-dihydro-2H-1,3-thiazine
SMILESC=CC1=C(C=C)SCNC1
InChIInChI=1S/C8H11NS/c1-3-7-5-9-6-10-8(7)4-2/h3-4,9H,1-2,5-6H2
InChIKeyLDDKFRGIFQBPNG-UHFFFAOYSA-N
XLogP1.91
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.25
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-Ethenyl-4-methylsulfanyl-1,2,3,6-tetrahydropyridine
CID 141953487
6-[(Z)-but-1-enyl]-5-ethenyl-2-methylidene-3,4-dihydro-1,3-thiazine
CID 142074118
(E)-2-ethenyl-N-methyl-3-methylsulfanylbut-2-en-1-amine
CID 145606999

Frequently Asked Questions

What is the IUPAC name of 5,6-bis(ethenyl)-3,4-dihydro-2H-1,3-thiazine?
The IUPAC name of 5,6-bis(ethenyl)-3,4-dihydro-2H-1,3-thiazine (CID 145093800) is 5,6-bis(ethenyl)-3,4-dihydro-2H-1,3-thiazine.
What is the SMILES notation for 5,6-bis(ethenyl)-3,4-dihydro-2H-1,3-thiazine?
The canonical SMILES for 5,6-bis(ethenyl)-3,4-dihydro-2H-1,3-thiazine is C=CC1=C(C=C)SCNC1.
What is the InChIKey of 5,6-bis(ethenyl)-3,4-dihydro-2H-1,3-thiazine?
The InChIKey is LDDKFRGIFQBPNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NS/c1-3-7-5-9-6-10-8(7)4-2/h3-4,9H,1-2,5-6H2.
What are the key properties of 5,6-bis(ethenyl)-3,4-dihydro-2H-1,3-thiazine?
5,6-bis(ethenyl)-3,4-dihydro-2H-1,3-thiazine has a molecular weight of 153.25 g/mol, XLogP of 1.91, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-bis(ethenyl)-3,4-dihydro-2H-1,3-thiazine is sourced from PubChem (CID 145093800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).