4-[2-(sulfinatoamino)ethyl]morpholine

C6H13N2O3S- — CID 66682422

IUPAC4-[2-(sulfinatoamino)ethyl]morpholine
SMILESO=S([O-])NCCN1CCOCC1
InChIInChI=1S/C6H14N2O3S/c9-12(10)7-1-2-8-3-5-11-6-4-8/h7H,1-6H2,(H,9,10)/p-1
InChIKeyJEQPNXPUOUOEAL-UHFFFAOYSA-M
MW193.25 g/mol
LogP-1.30
Rot. Bonds4

About 4-[2-(sulfinatoamino)ethyl]morpholine

4-[2-(sulfinatoamino)ethyl]morpholine (PubChem CID 66682422) has the molecular formula C6H13N2O3S- and a molecular weight of 193.25 g/mol. Its IUPAC name is 4-[2-(sulfinatoamino)ethyl]morpholine.

Molecular Properties

Compound Name4-[2-(sulfinatoamino)ethyl]morpholine
PubChem CID66682422
Molecular FormulaC6H13N2O3S-
Molecular Weight193.25 g/mol
Exact Mass193.07
IUPAC Name4-[2-(sulfinatoamino)ethyl]morpholine
SMILESO=S([O-])NCCN1CCOCC1
InChIInChI=1S/C6H14N2O3S/c9-12(10)7-1-2-8-3-5-11-6-4-8/h7H,1-6H2,(H,9,10)/p-1
InChIKeyJEQPNXPUOUOEAL-UHFFFAOYSA-M
XLogP-1.30
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 5-1.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-Morpholinoethylamine
CID 408285
N-methylmorpholine-4-sulfonamide
CID 14617449
Agn-PC-0NI21K
CID 12199060
Morpholin-4-ium sulfamate
CID 71438157
N-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]sulfamoyl fluoride
CID 166849929
4-[2-(Sulfosulfanylamino)ethyl]morpholine
CID 288591
N-(2-morpholin-4-ylethyl)methanesulfonamide
CID 1237764
2-Morpholin-4-ylethylsulfamic acid
CID 10192715
2-Morpholin-4-ylethylazanium chloride
CID 11084261
2-(4-Methylmorpholin-4-ium-4-yl)ethanamine
CID 17889324
Methanidyl(2-morpholin-4-ylethyl)azanium
CID 20723486
4-(2-Aminoethyl)morpholine 4-oxide
CID 21458639

Frequently Asked Questions

What is the IUPAC name of 4-[2-(sulfinatoamino)ethyl]morpholine?
The IUPAC name of 4-[2-(sulfinatoamino)ethyl]morpholine (CID 66682422) is 4-[2-(sulfinatoamino)ethyl]morpholine.
What is the SMILES notation for 4-[2-(sulfinatoamino)ethyl]morpholine?
The canonical SMILES for 4-[2-(sulfinatoamino)ethyl]morpholine is O=S([O-])NCCN1CCOCC1.
What is the InChIKey of 4-[2-(sulfinatoamino)ethyl]morpholine?
The InChIKey is JEQPNXPUOUOEAL-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H14N2O3S/c9-12(10)7-1-2-8-3-5-11-6-4-8/h7H,1-6H2,(H,9,10)/p-1.
What are the key properties of 4-[2-(sulfinatoamino)ethyl]morpholine?
4-[2-(sulfinatoamino)ethyl]morpholine has a molecular weight of 193.25 g/mol, XLogP of -1.30, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(sulfinatoamino)ethyl]morpholine is sourced from PubChem (CID 66682422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).