4-ethoxythiomorpholine

C6H13NOS — CID 69240675

IUPAC4-ethoxythiomorpholine
SMILESCCON1CCSCC1
InChIInChI=1S/C6H13NOS/c1-2-8-7-3-5-9-6-4-7/h2-6H2,1H3
InChIKeyMXACSIKXBAQNFJ-UHFFFAOYSA-N
MW147.24 g/mol
LogP0.99
Rot. Bonds2

About 4-ethoxythiomorpholine

4-ethoxythiomorpholine (PubChem CID 69240675) has the molecular formula C6H13NOS and a molecular weight of 147.24 g/mol. Its IUPAC name is 4-ethoxythiomorpholine.

Molecular Properties

Compound Name4-ethoxythiomorpholine
PubChem CID69240675
Molecular FormulaC6H13NOS
Molecular Weight147.24 g/mol
Exact Mass147.07
IUPAC Name4-ethoxythiomorpholine
SMILESCCON1CCSCC1
InChIInChI=1S/C6H13NOS/c1-2-8-7-3-5-9-6-4-7/h2-6H2,1H3
InChIKeyMXACSIKXBAQNFJ-UHFFFAOYSA-N
XLogP0.99
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.24
LogP ≤ 50.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-ethoxy-4-propan-2-ylpiperazine
CID 150580357
4-ethylthiomorpholine;hydroiodide
CID 143610004
1-ethoxy-3,5-dimethyl-1,3,5-triazinane
CID 89352923
4-methylthiomorpholine
CID 523249
4-[[1-(ethoxymethyl)cyclopropyl]methyl]thiomorpholine
CID 170601732
ethyl 2-thiomorpholin-4-ylpentanoate
CID 78964920
thiomorpholin-4-yl thiomorpholin-4-yloxysulfonyl sulfate
CID 142709456
1-ethoxyazetidin-2-one
CID 130291069
acetic acid;ethanesulfonic acid;1-ethoxypiperazine
CID 174521726
2-ethoxy-1-(1,4-thiazepan-4-yl)ethanone
CID 60776058
sodium;2-(4-ethoxypiperazin-1-yl)ethanesulfonic acid;hydride
CID 174954120
3-ethyl-1,3-thiazolidine
CID 15163846

Frequently Asked Questions

What is the IUPAC name of 4-ethoxythiomorpholine?
The IUPAC name of 4-ethoxythiomorpholine (CID 69240675) is 4-ethoxythiomorpholine.
What is the SMILES notation for 4-ethoxythiomorpholine?
The canonical SMILES for 4-ethoxythiomorpholine is CCON1CCSCC1.
What is the InChIKey of 4-ethoxythiomorpholine?
The InChIKey is MXACSIKXBAQNFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NOS/c1-2-8-7-3-5-9-6-4-7/h2-6H2,1H3.
What are the key properties of 4-ethoxythiomorpholine?
4-ethoxythiomorpholine has a molecular weight of 147.24 g/mol, XLogP of 0.99, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxythiomorpholine is sourced from PubChem (CID 69240675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).