2-[(3R)-5,5-difluoropiperidin-3-yl]-6-methyl-1,2,6-thiadiazinane 1,1-dioxide

C9H17F2N3O2S — CID 171524184

IUPAC2-[(3R)-5,5-difluoropiperidin-3-yl]-6-methyl-1,2,6-thiadiazinane 1,1-dioxide
SMILESCN1CCCN([C@H]2CNCC(F)(F)C2)S1(=O)=O
InChIInChI=1S/C9H17F2N3O2S/c1-13-3-2-4-14(17(13,15)16)8-5-9(10,11)7-12-6-8/h8,12H,2-7H2,1H3/t8-/m1/s1
InChIKeyUZRBVWOHNUORGE-MRVPVSSYSA-N
MW269.32 g/mol
LogP-0.13
Rot. Bonds1

About 2-[(3R)-5,5-difluoropiperidin-3-yl]-6-methyl-1,2,6-thiadiazinane 1,1-dioxide

2-[(3R)-5,5-difluoropiperidin-3-yl]-6-methyl-1,2,6-thiadiazinane 1,1-dioxide (PubChem CID 171524184) has the molecular formula C9H17F2N3O2S and a molecular weight of 269.32 g/mol. Its IUPAC name is 2-[(3R)-5,5-difluoropiperidin-3-yl]-6-methyl-1,2,6-thiadiazinane 1,1-dioxide.

Molecular Properties

Compound Name2-[(3R)-5,5-difluoropiperidin-3-yl]-6-methyl-1,2,6-thiadiazinane 1,1-dioxide
PubChem CID171524184
Molecular FormulaC9H17F2N3O2S
Molecular Weight269.32 g/mol
Exact Mass269.10
IUPAC Name2-[(3R)-5,5-difluoropiperidin-3-yl]-6-methyl-1,2,6-thiadiazinane 1,1-dioxide
SMILESCN1CCCN([C@H]2CNCC(F)(F)C2)S1(=O)=O
InChIInChI=1S/C9H17F2N3O2S/c1-13-3-2-4-14(17(13,15)16)8-5-9(10,11)7-12-6-8/h8,12H,2-7H2,1H3/t8-/m1/s1
InChIKeyUZRBVWOHNUORGE-MRVPVSSYSA-N
XLogP-0.13
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.32
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(3R)-5,5-difluoropiperidin-3-yl]-6-methyl-1,2,6-thiadiazinane 1,1-dioxide with MolForge

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Related Compounds

1-[(2-Methylpiperidin-1-yl)sulfonyl]piperazine
CID 16228166
3,3-difluoro-N-[2-(propylamino)ethyl]piperidine-1-sulfonamide
CID 117855268
4-[Sulfamoyl(3,3,3-trifluoropropyl)amino]piperidine
CID 167049379
1-(3,3-Difluoropiperidin-4-yl)-4-methylpiperazine
CID 168025347
1-(3,3-Difluoro-1-methylpiperidin-4-yl)piperazine;ethane
CID 177029060
N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)piperidine-1-sulfonamide
CID 43602826
N-(diethylsulfamoyl)-N-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 43602827
N-(dimethylsulfamoyl)-N-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 43602828
N-[2-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]ethyl]methanesulfonamide
CID 43771877
N-(1-piperidin-1-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 43791782
1,1,1-trifluoro-N-piperidin-3-yl-N-propylmethanesulfonamide
CID 55244348
N-ethyl-1,1-difluoro-N-piperidin-3-ylmethanesulfonamide
CID 60805703

Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-5,5-difluoropiperidin-3-yl]-6-methyl-1,2,6-thiadiazinane 1,1-dioxide?
The IUPAC name of 2-[(3R)-5,5-difluoropiperidin-3-yl]-6-methyl-1,2,6-thiadiazinane 1,1-dioxide (CID 171524184) is 2-[(3R)-5,5-difluoropiperidin-3-yl]-6-methyl-1,2,6-thiadiazinane 1,1-dioxide.
What is the SMILES notation for 2-[(3R)-5,5-difluoropiperidin-3-yl]-6-methyl-1,2,6-thiadiazinane 1,1-dioxide?
The canonical SMILES for 2-[(3R)-5,5-difluoropiperidin-3-yl]-6-methyl-1,2,6-thiadiazinane 1,1-dioxide is CN1CCCN([C@H]2CNCC(F)(F)C2)S1(=O)=O.
What is the InChIKey of 2-[(3R)-5,5-difluoropiperidin-3-yl]-6-methyl-1,2,6-thiadiazinane 1,1-dioxide?
The InChIKey is UZRBVWOHNUORGE-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H17F2N3O2S/c1-13-3-2-4-14(17(13,15)16)8-5-9(10,11)7-12-6-8/h8,12H,2-7H2,1H3/t8-/m1/s1.
What are the key properties of 2-[(3R)-5,5-difluoropiperidin-3-yl]-6-methyl-1,2,6-thiadiazinane 1,1-dioxide?
2-[(3R)-5,5-difluoropiperidin-3-yl]-6-methyl-1,2,6-thiadiazinane 1,1-dioxide has a molecular weight of 269.32 g/mol, XLogP of -0.13, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-5,5-difluoropiperidin-3-yl]-6-methyl-1,2,6-thiadiazinane 1,1-dioxide is sourced from PubChem (CID 171524184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).