4,5-dimethyl-2,3-dihydro-1,4-thiazine 1-oxide

C6H11NOS — CID 134923010

IUPAC4,5-dimethyl-2,3-dihydro-1,4-thiazine 1-oxide
SMILESCC1=CS(=O)CCN1C
InChIInChI=1S/C6H11NOS/c1-6-5-9(8)4-3-7(6)2/h5H,3-4H2,1-2H3
InChIKeyKNKOCEFLUBBCCZ-UHFFFAOYSA-N
MW145.23 g/mol
LogP0.54
Rot. Bonds

About 4,5-dimethyl-2,3-dihydro-1,4-thiazine 1-oxide

4,5-dimethyl-2,3-dihydro-1,4-thiazine 1-oxide (PubChem CID 134923010) has the molecular formula C6H11NOS and a molecular weight of 145.23 g/mol. Its IUPAC name is 4,5-dimethyl-2,3-dihydro-1,4-thiazine 1-oxide.

Molecular Properties

Compound Name4,5-dimethyl-2,3-dihydro-1,4-thiazine 1-oxide
PubChem CID134923010
Molecular FormulaC6H11NOS
Molecular Weight145.23 g/mol
Exact Mass145.06
IUPAC Name4,5-dimethyl-2,3-dihydro-1,4-thiazine 1-oxide
SMILESCC1=CS(=O)CCN1C
InChIInChI=1S/C6H11NOS/c1-6-5-9(8)4-3-7(6)2/h5H,3-4H2,1-2H3
InChIKeyKNKOCEFLUBBCCZ-UHFFFAOYSA-N
XLogP0.54
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.23
LogP ≤ 50.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4,5-dimethyl-3,4-dihydro-2H-1,4-thiazine 1,1-dioxide
CID 24975881
1-[(Z)-1-ethylsulfinylprop-1-en-2-yl]aziridine
CID 134933036
1-[(E)-1-ethylsulfinylprop-1-en-2-yl]aziridine
CID 134985988
1-(3-Ethylsulfinylprop-1-en-2-yl)aziridine
CID 134986134
(E)-N,N-dimethyl-1-methylsulfinylprop-1-en-2-amine
CID 13555975
4-Methyl-3-methylidene-1,4-thiazinane 1-oxide
CID 57557910
4-Methyl-3-methylidene-1,4-thiazinane 1,1-dioxide
CID 59520041
4,5-Dimethyl-2,3-dihydro-1,4-thiazine
CID 59751939
5-methyl-3,4-dihydro-2H-1,4-thiazine 1-oxide
CID 68099586
4-Prop-1-en-2-yl-1,4-thiazinane 1,1-dioxide
CID 68271847
4-Prop-1-en-2-yl-1,4-thiazinane 1-oxide
CID 146666329
N,N-diethyl-1,1-dioxo-2H-thiet-3-amine
CID 12244238

Frequently Asked Questions

What is the IUPAC name of 4,5-dimethyl-2,3-dihydro-1,4-thiazine 1-oxide?
The IUPAC name of 4,5-dimethyl-2,3-dihydro-1,4-thiazine 1-oxide (CID 134923010) is 4,5-dimethyl-2,3-dihydro-1,4-thiazine 1-oxide.
What is the SMILES notation for 4,5-dimethyl-2,3-dihydro-1,4-thiazine 1-oxide?
The canonical SMILES for 4,5-dimethyl-2,3-dihydro-1,4-thiazine 1-oxide is CC1=CS(=O)CCN1C.
What is the InChIKey of 4,5-dimethyl-2,3-dihydro-1,4-thiazine 1-oxide?
The InChIKey is KNKOCEFLUBBCCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NOS/c1-6-5-9(8)4-3-7(6)2/h5H,3-4H2,1-2H3.
What are the key properties of 4,5-dimethyl-2,3-dihydro-1,4-thiazine 1-oxide?
4,5-dimethyl-2,3-dihydro-1,4-thiazine 1-oxide has a molecular weight of 145.23 g/mol, XLogP of 0.54, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dimethyl-2,3-dihydro-1,4-thiazine 1-oxide is sourced from PubChem (CID 134923010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).