2-morpholin-4-yl-1-thiomorpholin-4-ylethanone

C10H18N2O2S — CID 66546738

IUPAC2-morpholin-4-yl-1-thiomorpholin-4-ylethanone
SMILESO=C(CN1CCOCC1)N1CCSCC1
InChIInChI=1S/C10H18N2O2S/c13-10(12-3-7-15-8-4-12)9-11-1-5-14-6-2-11/h1-9H2
InChIKeyNYLGUXLSACMCGI-UHFFFAOYSA-N
MW230.33 g/mol
LogP-0.11
Rot. Bonds2

About 2-morpholin-4-yl-1-thiomorpholin-4-ylethanone

2-morpholin-4-yl-1-thiomorpholin-4-ylethanone (PubChem CID 66546738) has the molecular formula C10H18N2O2S and a molecular weight of 230.33 g/mol. Its IUPAC name is 2-morpholin-4-yl-1-thiomorpholin-4-ylethanone.

Molecular Properties

Compound Name2-morpholin-4-yl-1-thiomorpholin-4-ylethanone
PubChem CID66546738
Molecular FormulaC10H18N2O2S
Molecular Weight230.33 g/mol
Exact Mass230.11
IUPAC Name2-morpholin-4-yl-1-thiomorpholin-4-ylethanone
SMILESO=C(CN1CCOCC1)N1CCSCC1
InChIInChI=1S/C10H18N2O2S/c13-10(12-3-7-15-8-4-12)9-11-1-5-14-6-2-11/h1-9H2
InChIKeyNYLGUXLSACMCGI-UHFFFAOYSA-N
XLogP-0.11
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.33
LogP ≤ 5-0.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-morpholin-4-yl-1-thiomorpholin-4-ylethanone 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 2-morpholin-4-yl-1-thiomorpholin-4-ylethanone?
The IUPAC name of 2-morpholin-4-yl-1-thiomorpholin-4-ylethanone (CID 66546738) is 2-morpholin-4-yl-1-thiomorpholin-4-ylethanone.
What is the SMILES notation for 2-morpholin-4-yl-1-thiomorpholin-4-ylethanone?
The canonical SMILES for 2-morpholin-4-yl-1-thiomorpholin-4-ylethanone is O=C(CN1CCOCC1)N1CCSCC1.
What is the InChIKey of 2-morpholin-4-yl-1-thiomorpholin-4-ylethanone?
The InChIKey is NYLGUXLSACMCGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2S/c13-10(12-3-7-15-8-4-12)9-11-1-5-14-6-2-11/h1-9H2.
What are the key properties of 2-morpholin-4-yl-1-thiomorpholin-4-ylethanone?
2-morpholin-4-yl-1-thiomorpholin-4-ylethanone has a molecular weight of 230.33 g/mol, XLogP of -0.11, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-1-thiomorpholin-4-ylethanone is sourced from PubChem (CID 66546738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).