1-(1-oxo-1,4-thiazinan-4-yl)-2-piperidin-3-ylethanone

C11H20N2O2S — CID 62691071

IUPAC1-(1-oxo-1,4-thiazinan-4-yl)-2-piperidin-3-ylethanone
SMILESO=C(CC1CCCNC1)N1CCS(=O)CC1
InChIInChI=1S/C11H20N2O2S/c14-11(8-10-2-1-3-12-9-10)13-4-6-16(15)7-5-13/h10,12H,1-9H2
InChIKeyXNADJYPOLDHDTO-UHFFFAOYSA-N
MW244.36 g/mol
LogP-0.03
Rot. Bonds2

About 1-(1-oxo-1,4-thiazinan-4-yl)-2-piperidin-3-ylethanone

1-(1-oxo-1,4-thiazinan-4-yl)-2-piperidin-3-ylethanone (PubChem CID 62691071) has the molecular formula C11H20N2O2S and a molecular weight of 244.36 g/mol. Its IUPAC name is 1-(1-oxo-1,4-thiazinan-4-yl)-2-piperidin-3-ylethanone.

Molecular Properties

Compound Name1-(1-oxo-1,4-thiazinan-4-yl)-2-piperidin-3-ylethanone
PubChem CID62691071
Molecular FormulaC11H20N2O2S
Molecular Weight244.36 g/mol
Exact Mass244.12
IUPAC Name1-(1-oxo-1,4-thiazinan-4-yl)-2-piperidin-3-ylethanone
SMILESO=C(CC1CCCNC1)N1CCS(=O)CC1
InChIInChI=1S/C11H20N2O2S/c14-11(8-10-2-1-3-12-9-10)13-4-6-16(15)7-5-13/h10,12H,1-9H2
InChIKeyXNADJYPOLDHDTO-UHFFFAOYSA-N
XLogP-0.03
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.36
LogP ≤ 5-0.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(1-oxo-1,4-thiazinan-4-yl)-2-piperidin-3-ylethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(3-azaspiro[5.5]undecan-3-yl)-2-piperidin-3-ylethanone
CID 62932288
1-(4-methoxypiperidin-1-yl)-2-piperidin-3-ylethanone
CID 62690713
1-[4-(1-hydroxyethyl)piperidin-1-yl]-2-piperidin-3-ylethanone
CID 106835886
methyl 1-(2-piperidin-3-ylacetyl)piperidine-4-carboxylate
CID 62674333
1-(4-ethoxypiperidin-1-yl)-2-piperidin-3-ylethanone
CID 62691409
1-(3-ethylpiperidin-1-yl)-2-piperidin-3-ylethanone
CID 62689348
2-cyclobutyl-1-(4-piperidin-3-ylpiperazin-1-yl)ethanone
CID 115277281
1-[4-(2-hydroxyethyl)-1,4-diazepan-1-yl]-2-piperidin-3-ylethanone
CID 107218340
1-methyl-4-(2-piperidin-3-ylacetyl)piperazin-2-one
CID 64682024
1-(3-methoxypyrrolidin-1-yl)-2-piperidin-3-ylethanone
CID 103532971
2-piperidin-3-yl-1-(3,3,4-trimethylpiperazin-1-yl)ethanone
CID 63634230
2-cyclopentyl-1-[4-(piperidine-3-carbonyl)-1,4-diazepan-1-yl]ethanone;hydrochloride
CID 119282220

Frequently Asked Questions

What is the IUPAC name of 1-(1-oxo-1,4-thiazinan-4-yl)-2-piperidin-3-ylethanone?
The IUPAC name of 1-(1-oxo-1,4-thiazinan-4-yl)-2-piperidin-3-ylethanone (CID 62691071) is 1-(1-oxo-1,4-thiazinan-4-yl)-2-piperidin-3-ylethanone.
What is the SMILES notation for 1-(1-oxo-1,4-thiazinan-4-yl)-2-piperidin-3-ylethanone?
The canonical SMILES for 1-(1-oxo-1,4-thiazinan-4-yl)-2-piperidin-3-ylethanone is O=C(CC1CCCNC1)N1CCS(=O)CC1.
What is the InChIKey of 1-(1-oxo-1,4-thiazinan-4-yl)-2-piperidin-3-ylethanone?
The InChIKey is XNADJYPOLDHDTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2S/c14-11(8-10-2-1-3-12-9-10)13-4-6-16(15)7-5-13/h10,12H,1-9H2.
What are the key properties of 1-(1-oxo-1,4-thiazinan-4-yl)-2-piperidin-3-ylethanone?
1-(1-oxo-1,4-thiazinan-4-yl)-2-piperidin-3-ylethanone has a molecular weight of 244.36 g/mol, XLogP of -0.03, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-oxo-1,4-thiazinan-4-yl)-2-piperidin-3-ylethanone is sourced from PubChem (CID 62691071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).