2-(2-methylpiperidin-4-yl)thiazinane 1,1-dioxide

C10H20N2O2S — CID 106996411

IUPAC2-(2-methylpiperidin-4-yl)thiazinane 1,1-dioxide
SMILESCC1CC(N2CCCCS2(=O)=O)CCN1
InChIInChI=1S/C10H20N2O2S/c1-9-8-10(4-5-11-9)12-6-2-3-7-15(12,13)14/h9-11H,2-8H2,1H3
InChIKeyZYXPYQHOJMFGDU-UHFFFAOYSA-N
MW232.35 g/mol
LogP0.55
Rot. Bonds1

About 2-(2-methylpiperidin-4-yl)thiazinane 1,1-dioxide

2-(2-methylpiperidin-4-yl)thiazinane 1,1-dioxide (PubChem CID 106996411) has the molecular formula C10H20N2O2S and a molecular weight of 232.35 g/mol. Its IUPAC name is 2-(2-methylpiperidin-4-yl)thiazinane 1,1-dioxide.

Molecular Properties

Compound Name2-(2-methylpiperidin-4-yl)thiazinane 1,1-dioxide
PubChem CID106996411
Molecular FormulaC10H20N2O2S
Molecular Weight232.35 g/mol
Exact Mass232.12
IUPAC Name2-(2-methylpiperidin-4-yl)thiazinane 1,1-dioxide
SMILESCC1CC(N2CCCCS2(=O)=O)CCN1
InChIInChI=1S/C10H20N2O2S/c1-9-8-10(4-5-11-9)12-6-2-3-7-15(12,13)14/h9-11H,2-8H2,1H3
InChIKeyZYXPYQHOJMFGDU-UHFFFAOYSA-N
XLogP0.55
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-pyrrolidin-3-ylthiazinane 1,1-dioxide
CID 83819748
(2R,4S)-2-methyl-4-pyrrolidin-1-ylpiperidine;dihydrochloride
CID 67314544
2-(azepan-4-yl)-1,2-thiazolidine 1,1-dioxide
CID 103655491
3-(1,1-dioxo-1,2-thiazolidin-2-yl)cyclohexane-1-carboxylic acid
CID 63042627
1-cyclopentyl-4-(2-methylpiperidin-4-yl)piperazine
CID 113482519
2-cyclopentyl-4-methyl-1,2,5-thiadiazepane 1,1-dioxide
CID 117016628
1-(2-methylpiperidin-4-yl)pyrrolidine-2,5-dione
CID 106996346
2-cyclopropyl-1,2,5-thiadiazocane 1,1-dioxide
CID 117015210
3-(1,1-dioxo-1,2-thiazolidin-2-yl)cyclobutan-1-amine
CID 61349589
1-(2-methylpiperidin-4-yl)-1,3-diazinan-2-one
CID 106996405
2-(1,1-dioxothiazinan-2-yl)cyclopentane-1-carboxylic acid
CID 83825294
2-(1,4-dioxaspiro[4.5]decan-8-yl)thiazinane 1,1-dioxide
CID 116816854

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpiperidin-4-yl)thiazinane 1,1-dioxide?
The IUPAC name of 2-(2-methylpiperidin-4-yl)thiazinane 1,1-dioxide (CID 106996411) is 2-(2-methylpiperidin-4-yl)thiazinane 1,1-dioxide.
What is the SMILES notation for 2-(2-methylpiperidin-4-yl)thiazinane 1,1-dioxide?
The canonical SMILES for 2-(2-methylpiperidin-4-yl)thiazinane 1,1-dioxide is CC1CC(N2CCCCS2(=O)=O)CCN1.
What is the InChIKey of 2-(2-methylpiperidin-4-yl)thiazinane 1,1-dioxide?
The InChIKey is ZYXPYQHOJMFGDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2S/c1-9-8-10(4-5-11-9)12-6-2-3-7-15(12,13)14/h9-11H,2-8H2,1H3.
What are the key properties of 2-(2-methylpiperidin-4-yl)thiazinane 1,1-dioxide?
2-(2-methylpiperidin-4-yl)thiazinane 1,1-dioxide has a molecular weight of 232.35 g/mol, XLogP of 0.55, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpiperidin-4-yl)thiazinane 1,1-dioxide is sourced from PubChem (CID 106996411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).