4-(4-methylpiperidin-3-yl)-1,4-thiazinane 1-oxide

C10H20N2OS — CID 66273495

IUPAC4-(4-methylpiperidin-3-yl)-1,4-thiazinane 1-oxide
SMILESCC1CCNCC1N1CCS(=O)CC1
InChIInChI=1S/C10H20N2OS/c1-9-2-3-11-8-10(9)12-4-6-14(13)7-5-12/h9-11H,2-8H2,1H3
InChIKeyDJTMDSKUUCYRFL-UHFFFAOYSA-N
MW216.35 g/mol
LogP0.05
Rot. Bonds1

About 4-(4-methylpiperidin-3-yl)-1,4-thiazinane 1-oxide

4-(4-methylpiperidin-3-yl)-1,4-thiazinane 1-oxide (PubChem CID 66273495) has the molecular formula C10H20N2OS and a molecular weight of 216.35 g/mol. Its IUPAC name is 4-(4-methylpiperidin-3-yl)-1,4-thiazinane 1-oxide.

Molecular Properties

Compound Name4-(4-methylpiperidin-3-yl)-1,4-thiazinane 1-oxide
PubChem CID66273495
Molecular FormulaC10H20N2OS
Molecular Weight216.35 g/mol
Exact Mass216.13
IUPAC Name4-(4-methylpiperidin-3-yl)-1,4-thiazinane 1-oxide
SMILESCC1CCNCC1N1CCS(=O)CC1
InChIInChI=1S/C10H20N2OS/c1-9-2-3-11-8-10(9)12-4-6-14(13)7-5-12/h9-11H,2-8H2,1H3
InChIKeyDJTMDSKUUCYRFL-UHFFFAOYSA-N
XLogP0.05
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.35
LogP ≤ 50.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-1-(4-methylpiperidin-3-yl)piperidin-4-amine
CID 66271353
9-methyl-3-(4-methylpiperidin-3-yl)-3,9-diazabicyclo[4.2.1]nonane
CID 79174792
(3R,4R)-4-(1-oxo-1,4-thiazinan-4-yl)pyrrolidin-3-ol
CID 122236780
2-methyl-4-(4-methylpiperidin-3-yl)morpholine
CID 66272849
1-(4-methylpiperidin-3-yl)-4-propylazepane
CID 66273079
(3R,4S)-3-methyl-4-pyrrolidin-1-ylpiperidine
CID 67315323
4-methyl-3-(2-methylpyrrolidin-1-yl)piperidine
CID 66271783
1-(4-methylpiperidin-3-yl)pyrrolidine-2,5-dione
CID 63329933
1-(4-methylpiperidin-3-yl)-3-(trifluoromethyl)piperidine
CID 66273927
1-(2-fluorophenyl)-4-(4-methylpiperidin-3-yl)piperazine
CID 66271782
2-methyl-1-(4-methylpiperidin-3-yl)piperidine
CID 66272425
(3S,4R)-3-methyl-4-pyrrolidin-1-ylpiperidine;dihydrochloride
CID 67315320

Frequently Asked Questions

What is the IUPAC name of 4-(4-methylpiperidin-3-yl)-1,4-thiazinane 1-oxide?
The IUPAC name of 4-(4-methylpiperidin-3-yl)-1,4-thiazinane 1-oxide (CID 66273495) is 4-(4-methylpiperidin-3-yl)-1,4-thiazinane 1-oxide.
What is the SMILES notation for 4-(4-methylpiperidin-3-yl)-1,4-thiazinane 1-oxide?
The canonical SMILES for 4-(4-methylpiperidin-3-yl)-1,4-thiazinane 1-oxide is CC1CCNCC1N1CCS(=O)CC1.
What is the InChIKey of 4-(4-methylpiperidin-3-yl)-1,4-thiazinane 1-oxide?
The InChIKey is DJTMDSKUUCYRFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2OS/c1-9-2-3-11-8-10(9)12-4-6-14(13)7-5-12/h9-11H,2-8H2,1H3.
What are the key properties of 4-(4-methylpiperidin-3-yl)-1,4-thiazinane 1-oxide?
4-(4-methylpiperidin-3-yl)-1,4-thiazinane 1-oxide has a molecular weight of 216.35 g/mol, XLogP of 0.05, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methylpiperidin-3-yl)-1,4-thiazinane 1-oxide is sourced from PubChem (CID 66273495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).