5,6-bis(ethenyl)-4-methyl-2,3-dihydro-1,4-thiazine;ethane

C11H19NS — CID 142222939

IUPAC5,6-bis(ethenyl)-4-methyl-2,3-dihydro-1,4-thiazine;ethane
SMILESC=CC1=C(C=C)N(C)CCS1.CC
InChIInChI=1S/C9H13NS.C2H6/c1-4-8-9(5-2)11-7-6-10(8)3;1-2/h4-5H,1-2,6-7H2,3H3;1-2H3
InChIKeyJBPDSCDMFJYQOK-UHFFFAOYSA-N
MW197.35 g/mol
LogP3.27
Rot. Bonds2

About 5,6-bis(ethenyl)-4-methyl-2,3-dihydro-1,4-thiazine;ethane

5,6-bis(ethenyl)-4-methyl-2,3-dihydro-1,4-thiazine;ethane (PubChem CID 142222939) has the molecular formula C11H19NS and a molecular weight of 197.35 g/mol. Its IUPAC name is 5,6-bis(ethenyl)-4-methyl-2,3-dihydro-1,4-thiazine;ethane.

Molecular Properties

Compound Name5,6-bis(ethenyl)-4-methyl-2,3-dihydro-1,4-thiazine;ethane
PubChem CID142222939
Molecular FormulaC11H19NS
Molecular Weight197.35 g/mol
Exact Mass197.12
IUPAC Name5,6-bis(ethenyl)-4-methyl-2,3-dihydro-1,4-thiazine;ethane
SMILESC=CC1=C(C=C)N(C)CCS1.CC
InChIInChI=1S/C9H13NS.C2H6/c1-4-8-9(5-2)11-7-6-10(8)3;1-2/h4-5H,1-2,6-7H2,3H3;1-2H3
InChIKeyJBPDSCDMFJYQOK-UHFFFAOYSA-N
XLogP3.27
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.35
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5,6-bis(ethenyl)-4-methyl-2,3-dihydro-1,4-thiazine
CID 142222940
ethane;3-methyl-2-methylidene-1,3-thiazolidine
CID 91514218
ethane;3-methyl-1,3-thiazolidin-2-one
CID 90778752
ethane;N-(6-ethenyl-1-methyl-3,4-dihydro-2H-pyridin-5-yl)methanimine
CID 143157788
6,7-bis(ethenyl)-2,3,4,5-tetrahydrothiepine;ethane
CID 145445836
5,6-bis(ethenyl)-4-methyl-2,3-dihydro-1,4-oxazine
CID 143157637
3,4-bis(ethenyl)-5-methyl-2-thia-5-azabicyclo[5.5.0]dodeca-1(7),3,8,11-tetraene
CID 142986165
4-methyl-1,4-thiazocane-5,8-dione
CID 134569914
4,5-bis(ethenyl)-3-methyl-6H-1,3-thiazin-2-one;ethane
CID 143838750
4-methyl-3-methylidenethiomorpholine
CID 59520043
(Z)-2-(4-ethenyl-1-methyl-2,3-dihydropyrrol-5-yl)ethenamine
CID 89012398
ethane;4-methyl-2,3-dihydro-1,4-benzothiazine
CID 142222955

Frequently Asked Questions

What is the IUPAC name of 5,6-bis(ethenyl)-4-methyl-2,3-dihydro-1,4-thiazine;ethane?
The IUPAC name of 5,6-bis(ethenyl)-4-methyl-2,3-dihydro-1,4-thiazine;ethane (CID 142222939) is 5,6-bis(ethenyl)-4-methyl-2,3-dihydro-1,4-thiazine;ethane.
What is the SMILES notation for 5,6-bis(ethenyl)-4-methyl-2,3-dihydro-1,4-thiazine;ethane?
The canonical SMILES for 5,6-bis(ethenyl)-4-methyl-2,3-dihydro-1,4-thiazine;ethane is C=CC1=C(C=C)N(C)CCS1.CC.
What is the InChIKey of 5,6-bis(ethenyl)-4-methyl-2,3-dihydro-1,4-thiazine;ethane?
The InChIKey is JBPDSCDMFJYQOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NS.C2H6/c1-4-8-9(5-2)11-7-6-10(8)3;1-2/h4-5H,1-2,6-7H2,3H3;1-2H3.
What are the key properties of 5,6-bis(ethenyl)-4-methyl-2,3-dihydro-1,4-thiazine;ethane?
5,6-bis(ethenyl)-4-methyl-2,3-dihydro-1,4-thiazine;ethane has a molecular weight of 197.35 g/mol, XLogP of 3.27, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-bis(ethenyl)-4-methyl-2,3-dihydro-1,4-thiazine;ethane is sourced from PubChem (CID 142222939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).