1-(3-ethylsulfonylthiomorpholin-4-yl)-N-methylpropan-2-amine

C10H22N2O2S2 — CID 66375830

IUPAC1-(3-ethylsulfonylthiomorpholin-4-yl)-N-methylpropan-2-amine
SMILESCCS(=O)(=O)C1CSCCN1CC(C)NC
InChIInChI=1S/C10H22N2O2S2/c1-4-16(13,14)10-8-15-6-5-12(10)7-9(2)11-3/h9-11H,4-8H2,1-3H3
InChIKeyOXCWZPOMNZMQHD-UHFFFAOYSA-N
MW266.43 g/mol
LogP0.40
Rot. Bonds5

About 1-(3-ethylsulfonylthiomorpholin-4-yl)-N-methylpropan-2-amine

1-(3-ethylsulfonylthiomorpholin-4-yl)-N-methylpropan-2-amine (PubChem CID 66375830) has the molecular formula C10H22N2O2S2 and a molecular weight of 266.43 g/mol. Its IUPAC name is 1-(3-ethylsulfonylthiomorpholin-4-yl)-N-methylpropan-2-amine.

Molecular Properties

Compound Name1-(3-ethylsulfonylthiomorpholin-4-yl)-N-methylpropan-2-amine
PubChem CID66375830
Molecular FormulaC10H22N2O2S2
Molecular Weight266.43 g/mol
Exact Mass266.11
IUPAC Name1-(3-ethylsulfonylthiomorpholin-4-yl)-N-methylpropan-2-amine
SMILESCCS(=O)(=O)C1CSCCN1CC(C)NC
InChIInChI=1S/C10H22N2O2S2/c1-4-16(13,14)10-8-15-6-5-12(10)7-9(2)11-3/h9-11H,4-8H2,1-3H3
InChIKeyOXCWZPOMNZMQHD-UHFFFAOYSA-N
XLogP0.40
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(3-ethylsulfonylthiomorpholin-4-yl)-N-methylpropan-2-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethylsulfonylthiomorpholin-4-yl)-N-methylpropan-2-amine?
The IUPAC name of 1-(3-ethylsulfonylthiomorpholin-4-yl)-N-methylpropan-2-amine (CID 66375830) is 1-(3-ethylsulfonylthiomorpholin-4-yl)-N-methylpropan-2-amine.
What is the SMILES notation for 1-(3-ethylsulfonylthiomorpholin-4-yl)-N-methylpropan-2-amine?
The canonical SMILES for 1-(3-ethylsulfonylthiomorpholin-4-yl)-N-methylpropan-2-amine is CCS(=O)(=O)C1CSCCN1CC(C)NC.
What is the InChIKey of 1-(3-ethylsulfonylthiomorpholin-4-yl)-N-methylpropan-2-amine?
The InChIKey is OXCWZPOMNZMQHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2S2/c1-4-16(13,14)10-8-15-6-5-12(10)7-9(2)11-3/h9-11H,4-8H2,1-3H3.
What are the key properties of 1-(3-ethylsulfonylthiomorpholin-4-yl)-N-methylpropan-2-amine?
1-(3-ethylsulfonylthiomorpholin-4-yl)-N-methylpropan-2-amine has a molecular weight of 266.43 g/mol, XLogP of 0.40, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethylsulfonylthiomorpholin-4-yl)-N-methylpropan-2-amine is sourced from PubChem (CID 66375830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).