(5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazine

C6H11NS — CID 58230856

IUPAC(5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazine
SMILESC[C@@H]1SC=NC[C@@H]1C
InChIInChI=1S/C6H11NS/c1-5-3-7-4-8-6(5)2/h4-6H,3H2,1-2H3/t5-,6-/m0/s1
InChIKeyFXEDVKYIBATPKO-WDSKDSINSA-N
MW129.23 g/mol
LogP1.79
Rot. Bonds

About (5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazine

(5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazine (PubChem CID 58230856) has the molecular formula C6H11NS and a molecular weight of 129.23 g/mol. Its IUPAC name is (5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazine.

Molecular Properties

Compound Name(5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazine
PubChem CID58230856
Molecular FormulaC6H11NS
Molecular Weight129.23 g/mol
Exact Mass129.06
IUPAC Name(5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazine
SMILESC[C@@H]1SC=NC[C@@H]1C
InChIInChI=1S/C6H11NS/c1-5-3-7-4-8-6(5)2/h4-6H,3H2,1-2H3/t5-,6-/m0/s1
InChIKeyFXEDVKYIBATPKO-WDSKDSINSA-N
XLogP1.79
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.23
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazine with MolForge

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Launch Full Analysis

Related Compounds

(s)-4-Isopropyl-4,5-dihydro-thiazole
CID 101620143
5,6-Dimethyl-2-methylthio-5,6-dihydro-4h-1,3-thiazine
CID 129790584
6-methyl-5,6-dihydro-4H-1,3-thiazine
CID 12485352
5-Tert-butyl-4,5-dihydro-1,3-thiazole
CID 23383503
(4R,5S)-4,5-dimethyl-5,6-dihydro-4H-1,3-thiazine
CID 58230853
5-propan-2-yl-5,6-dihydro-4H-1,3-thiazine
CID 58473770
4-propan-2-yl-5,6-dihydro-4H-1,3-thiazine
CID 58473771
4-Propan-2-yl-4,5-dihydro-1,3-thiazole
CID 58473813
(5S,6S)-5,6-dimethyl-1,1-dimethylidene-5,6-dihydro-4H-1,3-thiazine
CID 59584698
(4R,5S)-4,5-dimethyl-1,1-dimethylidene-5,6-dihydro-4H-1,3-thiazine
CID 59584716
5-methyl-6-propan-2-yl-5,6-dihydro-4H-1,3-thiazine
CID 67557826
5-Propan-2-yl-4,5-dihydro-1,3-thiazole
CID 88985873

Frequently Asked Questions

What is the IUPAC name of (5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazine?
The IUPAC name of (5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazine (CID 58230856) is (5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazine.
What is the SMILES notation for (5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazine?
The canonical SMILES for (5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazine is C[C@@H]1SC=NC[C@@H]1C.
What is the InChIKey of (5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazine?
The InChIKey is FXEDVKYIBATPKO-WDSKDSINSA-N. The full InChI is InChI=1S/C6H11NS/c1-5-3-7-4-8-6(5)2/h4-6H,3H2,1-2H3/t5-,6-/m0/s1.
What are the key properties of (5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazine?
(5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazine has a molecular weight of 129.23 g/mol, XLogP of 1.79, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazine is sourced from PubChem (CID 58230856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).