2-(2-hydroxyethylsulfinyl)-1-morpholin-4-ylethanone

C8H15NO4S — CID 123101652

IUPAC2-(2-hydroxyethylsulfinyl)-1-morpholin-4-ylethanone
SMILESO=C(CS(=O)CCO)N1CCOCC1
InChIInChI=1S/C8H15NO4S/c10-3-6-14(12)7-8(11)9-1-4-13-5-2-9/h10H,1-7H2
InChIKeyIKXZASRTBYXBMI-UHFFFAOYSA-N
MW221.28 g/mol
LogP-1.41
Rot. Bonds4

About 2-(2-hydroxyethylsulfinyl)-1-morpholin-4-ylethanone

2-(2-hydroxyethylsulfinyl)-1-morpholin-4-ylethanone (PubChem CID 123101652) has the molecular formula C8H15NO4S and a molecular weight of 221.28 g/mol. Its IUPAC name is 2-(2-hydroxyethylsulfinyl)-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-(2-hydroxyethylsulfinyl)-1-morpholin-4-ylethanone
PubChem CID123101652
Molecular FormulaC8H15NO4S
Molecular Weight221.28 g/mol
Exact Mass221.07
IUPAC Name2-(2-hydroxyethylsulfinyl)-1-morpholin-4-ylethanone
SMILESO=C(CS(=O)CCO)N1CCOCC1
InChIInChI=1S/C8H15NO4S/c10-3-6-14(12)7-8(11)9-1-4-13-5-2-9/h10H,1-7H2
InChIKeyIKXZASRTBYXBMI-UHFFFAOYSA-N
XLogP-1.41
TPSA66.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.28
LogP ≤ 5-1.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyethylsulfinyl)-1-morpholin-4-ylethanone?
The IUPAC name of 2-(2-hydroxyethylsulfinyl)-1-morpholin-4-ylethanone (CID 123101652) is 2-(2-hydroxyethylsulfinyl)-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-(2-hydroxyethylsulfinyl)-1-morpholin-4-ylethanone?
The canonical SMILES for 2-(2-hydroxyethylsulfinyl)-1-morpholin-4-ylethanone is O=C(CS(=O)CCO)N1CCOCC1.
What is the InChIKey of 2-(2-hydroxyethylsulfinyl)-1-morpholin-4-ylethanone?
The InChIKey is IKXZASRTBYXBMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO4S/c10-3-6-14(12)7-8(11)9-1-4-13-5-2-9/h10H,1-7H2.
What are the key properties of 2-(2-hydroxyethylsulfinyl)-1-morpholin-4-ylethanone?
2-(2-hydroxyethylsulfinyl)-1-morpholin-4-ylethanone has a molecular weight of 221.28 g/mol, XLogP of -1.41, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyethylsulfinyl)-1-morpholin-4-ylethanone is sourced from PubChem (CID 123101652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).