4-(2-hydroxysulfanylethyl)morpholine

C6H13NO2S — CID 166162246

IUPAC4-(2-hydroxysulfanylethyl)morpholine
SMILESOSCCN1CCOCC1
InChIInChI=1S/C6H13NO2S/c8-10-6-3-7-1-4-9-5-2-7/h8H,1-6H2
InChIKeyLNGCNGDWGHFWJO-UHFFFAOYSA-N
MW163.24 g/mol
LogP0.52
Rot. Bonds3

About 4-(2-hydroxysulfanylethyl)morpholine

4-(2-hydroxysulfanylethyl)morpholine (PubChem CID 166162246) has the molecular formula C6H13NO2S and a molecular weight of 163.24 g/mol. Its IUPAC name is 4-(2-hydroxysulfanylethyl)morpholine.

Molecular Properties

Compound Name4-(2-hydroxysulfanylethyl)morpholine
PubChem CID166162246
Molecular FormulaC6H13NO2S
Molecular Weight163.24 g/mol
Exact Mass163.07
IUPAC Name4-(2-hydroxysulfanylethyl)morpholine
SMILESOSCCN1CCOCC1
InChIInChI=1S/C6H13NO2S/c8-10-6-3-7-1-4-9-5-2-7/h8H,1-6H2
InChIKeyLNGCNGDWGHFWJO-UHFFFAOYSA-N
XLogP0.52
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.24
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'sulfur_oxygen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-(2-isocyanosulfanylethyl)morpholine
CID 151698535
2-morpholin-4-ylethyl thiocyanate
CID 59595122
2-morpholin-4-ylethyl N'-aminocarbamimidothioate
CID 77060850
4-[2-(2,2-dimethylpropyldisulfanyl)ethyl]morpholine
CID 118259793
3-(2-morpholin-4-ylethylsulfanyl)phenol
CID 104590753
2-morpholin-4-ylethanol;rutherfordium
CID 58855452
4-(3-methylsulfanylpropyl)morpholine
CID 2247110
16-[10-(1,4,7,10,13-pentaoxa-16-azacyclooctadec-16-yl)decyl]-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
CID 15145347
4-[2-(4-methylpiperazin-1-yl)ethyl]morpholine
CID 20719664
4-[2-[2-(disulfanyl)propan-2-ylsulfanyl]ethyl]morpholine
CID 134232913
4-[2-[(3E)-3-bromopenta-1,3-dien-2-yl]sulfanylethyl]morpholine
CID 145010526
2-morpholin-4-ylethyl piperazine-1-carbodithioate
CID 125486501

Frequently Asked Questions

What is the IUPAC name of 4-(2-hydroxysulfanylethyl)morpholine?
The IUPAC name of 4-(2-hydroxysulfanylethyl)morpholine (CID 166162246) is 4-(2-hydroxysulfanylethyl)morpholine.
What is the SMILES notation for 4-(2-hydroxysulfanylethyl)morpholine?
The canonical SMILES for 4-(2-hydroxysulfanylethyl)morpholine is OSCCN1CCOCC1.
What is the InChIKey of 4-(2-hydroxysulfanylethyl)morpholine?
The InChIKey is LNGCNGDWGHFWJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO2S/c8-10-6-3-7-1-4-9-5-2-7/h8H,1-6H2.
What are the key properties of 4-(2-hydroxysulfanylethyl)morpholine?
4-(2-hydroxysulfanylethyl)morpholine has a molecular weight of 163.24 g/mol, XLogP of 0.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-hydroxysulfanylethyl)morpholine is sourced from PubChem (CID 166162246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).