4-(azetidin-3-yloxy)-1-ethylsulfonylpiperidine

C10H20N2O3S — CID 165457594

IUPAC4-(azetidin-3-yloxy)-1-ethylsulfonylpiperidine
SMILESCCS(=O)(=O)N1CCC(OC2CNC2)CC1
InChIInChI=1S/C10H20N2O3S/c1-2-16(13,14)12-5-3-9(4-6-12)15-10-7-11-8-10/h9-11H,2-8H2,1H3
InChIKeyOERNDXUOWMDYBV-UHFFFAOYSA-N
MW248.35 g/mol
LogP-0.21
Rot. Bonds4

About 4-(azetidin-3-yloxy)-1-ethylsulfonylpiperidine

4-(azetidin-3-yloxy)-1-ethylsulfonylpiperidine (PubChem CID 165457594) has the molecular formula C10H20N2O3S and a molecular weight of 248.35 g/mol. Its IUPAC name is 4-(azetidin-3-yloxy)-1-ethylsulfonylpiperidine.

Molecular Properties

Compound Name4-(azetidin-3-yloxy)-1-ethylsulfonylpiperidine
PubChem CID165457594
Molecular FormulaC10H20N2O3S
Molecular Weight248.35 g/mol
Exact Mass248.12
IUPAC Name4-(azetidin-3-yloxy)-1-ethylsulfonylpiperidine
SMILESCCS(=O)(=O)N1CCC(OC2CNC2)CC1
InChIInChI=1S/C10H20N2O3S/c1-2-16(13,14)12-5-3-9(4-6-12)15-10-7-11-8-10/h9-11H,2-8H2,1H3
InChIKeyOERNDXUOWMDYBV-UHFFFAOYSA-N
XLogP-0.21
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.35
LogP ≤ 5-0.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(azetidin-3-yloxy)-1-ethylsulfonylpiperidine 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

4-(azetidin-3-yloxy)-1-cyclopropylsulfonylpiperidine
CID 165450816
4-(azetidin-3-yloxy)-1-methylpiperidine
CID 146420292
4-(azetidin-3-yloxy)-N-butylpiperidine-1-carboxamide
CID 165457542
1-ethylsulfonyl-4-(4-fluorophenoxy)piperidine
CID 110396981
3-(cyclopropylmethoxy)-1-ethylsulfonylpyrrolidine
CID 121197695
1-[2-(azetidin-3-yloxy)ethylsulfonyl]pyrrolidine
CID 165492667
(1-ethylsulfonylpiperidin-4-yl)methanamine
CID 28706827
4-[(1R)-2-[2-[(3S)-1-ethylsulfonylpyrrolidin-3-yl]oxyethyl]cyclopropyl]piperidine
CID 126693796
(5S)-3-ethylsulfonyl-3,7-diazabicyclo[3.3.1]nonane
CID 163809174
ethyl 1-ethylsulfonylpiperidine-4-carboxylate
CID 17022443
azetidin-3-yl methanesulfonate
CID 7330605
3-chloro-1-ethylsulfonyl-4-methylpiperidine
CID 102962546

Frequently Asked Questions

What is the IUPAC name of 4-(azetidin-3-yloxy)-1-ethylsulfonylpiperidine?
The IUPAC name of 4-(azetidin-3-yloxy)-1-ethylsulfonylpiperidine (CID 165457594) is 4-(azetidin-3-yloxy)-1-ethylsulfonylpiperidine.
What is the SMILES notation for 4-(azetidin-3-yloxy)-1-ethylsulfonylpiperidine?
The canonical SMILES for 4-(azetidin-3-yloxy)-1-ethylsulfonylpiperidine is CCS(=O)(=O)N1CCC(OC2CNC2)CC1.
What is the InChIKey of 4-(azetidin-3-yloxy)-1-ethylsulfonylpiperidine?
The InChIKey is OERNDXUOWMDYBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3S/c1-2-16(13,14)12-5-3-9(4-6-12)15-10-7-11-8-10/h9-11H,2-8H2,1H3.
What are the key properties of 4-(azetidin-3-yloxy)-1-ethylsulfonylpiperidine?
4-(azetidin-3-yloxy)-1-ethylsulfonylpiperidine has a molecular weight of 248.35 g/mol, XLogP of -0.21, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(azetidin-3-yloxy)-1-ethylsulfonylpiperidine is sourced from PubChem (CID 165457594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).