5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]-2,3-dihydro-1,4-thiazine 1,1-dioxide

C10H15NO2S — CID 129238807

IUPAC5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]-2,3-dihydro-1,4-thiazine 1,1-dioxide
SMILESC=CC1=C(/C=C\C)S(=O)(=O)CCN1C
InChIInChI=1S/C10H15NO2S/c1-4-6-10-9(5-2)11(3)7-8-14(10,12)13/h4-6H,2,7-8H2,1,3H3/b6-4-
InChIKeyVMHMQKPQIYUUPQ-XQRVVYSFSA-N
MW213.30 g/mol
LogP1.32
Rot. Bonds2

About 5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]-2,3-dihydro-1,4-thiazine 1,1-dioxide

5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]-2,3-dihydro-1,4-thiazine 1,1-dioxide (PubChem CID 129238807) has the molecular formula C10H15NO2S and a molecular weight of 213.30 g/mol. Its IUPAC name is 5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]-2,3-dihydro-1,4-thiazine 1,1-dioxide.

Molecular Properties

Compound Name5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]-2,3-dihydro-1,4-thiazine 1,1-dioxide
PubChem CID129238807
Molecular FormulaC10H15NO2S
Molecular Weight213.30 g/mol
Exact Mass213.08
IUPAC Name5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]-2,3-dihydro-1,4-thiazine 1,1-dioxide
SMILESC=CC1=C(/C=C\C)S(=O)(=O)CCN1C
InChIInChI=1S/C10H15NO2S/c1-4-6-10-9(5-2)11(3)7-8-14(10,12)13/h4-6H,2,7-8H2,1,3H3/b6-4-
InChIKeyVMHMQKPQIYUUPQ-XQRVVYSFSA-N
XLogP1.32
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.30
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(6-methyl-2H-pyridin-1-yl)propane-1-sulfonic acid
CID 19808205
1-chloro-5-propan-2-ylsulfonyl-2H-pyridine
CID 53642732
copper(1+);3-(6-methyl-2H-pyridin-1-yl)propane-1-sulfonate
CID 88609835
4-(4-Methylpenta-1,3-dien-3-yl)-1,4-thiazinane 1,1-dioxide
CID 123230833
4-Buta-1,3-dien-2-yl-1,4-thiazinane 1,1-dioxide
CID 123468682
4-Penta-1,3-dien-3-yl-1,4-thiazinane 1,1-dioxide
CID 123532534
4-Hexa-1,3-dien-3-yl-1,4-thiazinane 1,1-dioxide
CID 123713020
4-But-2-en-2-yl-1,4-thiazinane 1,1-dioxide
CID 123875902
4-[(E)-but-2-enyl]-1,4-thiazinane 1,1-dioxide
CID 131247911
1-methyl-2-methylsulfonyl-2H-pyridine-6-carbonitrile
CID 134449122
1-methyl-5-methylsulfonyl-2H-pyridine
CID 141417136
5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]-2,3-dihydro-1,4-thiazine 1-oxide
CID 143520601

Frequently Asked Questions

What is the IUPAC name of 5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]-2,3-dihydro-1,4-thiazine 1,1-dioxide?
The IUPAC name of 5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]-2,3-dihydro-1,4-thiazine 1,1-dioxide (CID 129238807) is 5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]-2,3-dihydro-1,4-thiazine 1,1-dioxide.
What is the SMILES notation for 5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]-2,3-dihydro-1,4-thiazine 1,1-dioxide?
The canonical SMILES for 5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]-2,3-dihydro-1,4-thiazine 1,1-dioxide is C=CC1=C(/C=C\C)S(=O)(=O)CCN1C.
What is the InChIKey of 5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]-2,3-dihydro-1,4-thiazine 1,1-dioxide?
The InChIKey is VMHMQKPQIYUUPQ-XQRVVYSFSA-N. The full InChI is InChI=1S/C10H15NO2S/c1-4-6-10-9(5-2)11(3)7-8-14(10,12)13/h4-6H,2,7-8H2,1,3H3/b6-4-.
What are the key properties of 5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]-2,3-dihydro-1,4-thiazine 1,1-dioxide?
5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]-2,3-dihydro-1,4-thiazine 1,1-dioxide has a molecular weight of 213.30 g/mol, XLogP of 1.32, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-4-methyl-6-[(Z)-prop-1-enyl]-2,3-dihydro-1,4-thiazine 1,1-dioxide is sourced from PubChem (CID 129238807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).