4-morpholin-4-ium-4-ylmorpholine

C8H17N2O2+ — CID 154404125

IUPAC4-morpholin-4-ium-4-ylmorpholine
SMILESC1CN([NH+]2CCOCC2)CCO1
InChIInChI=1S/C8H16N2O2/c1-5-11-6-2-9(1)10-3-7-12-8-4-10/h1-8H2/p+1
InChIKeyBOQWOOLSORMISR-UHFFFAOYSA-O
MW173.24 g/mol
LogP-1.85
Rot. Bonds1

About 4-morpholin-4-ium-4-ylmorpholine

4-morpholin-4-ium-4-ylmorpholine (PubChem CID 154404125) has the molecular formula C8H17N2O2+ and a molecular weight of 173.24 g/mol. Its IUPAC name is 4-morpholin-4-ium-4-ylmorpholine.

Molecular Properties

Compound Name4-morpholin-4-ium-4-ylmorpholine
PubChem CID154404125
Molecular FormulaC8H17N2O2+
Molecular Weight173.24 g/mol
Exact Mass173.13
IUPAC Name4-morpholin-4-ium-4-ylmorpholine
SMILESC1CN([NH+]2CCOCC2)CCO1
InChIInChI=1S/C8H16N2O2/c1-5-11-6-2-9(1)10-3-7-12-8-4-10/h1-8H2/p+1
InChIKeyBOQWOOLSORMISR-UHFFFAOYSA-O
XLogP-1.85
TPSA26.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.24
LogP ≤ 5-1.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

CID 135034340
CID 135034340
2,2-dimorpholin-4-ylacetonitrile
CID 12502867
diiodo(dimorpholin-4-yl)-λ4-sulfane
CID 131966372
morpholin-4-ylazanide
CID 59315595
19-methyl-1,4,7,10,13,16-hexaoxa-19-azacyclohenicosane
CID 6612303
potassium;4,7,13,16,21,24-hexaoxa-1,10-diazabicyclo[8.8.8]hexacosane;chloride
CID 23689698
1,4,7-dioxazonan-7-amine
CID 147560539
4-(morpholin-4-ylmethyl)morpholine
CID 21839
morpholin-4-ylaluminum(2+) dichloride
CID 174418482
ethane;4-methylmorpholine
CID 54432133
4-diaminophosphinothioylmorpholine
CID 57020028
4-(trioxidanyl)morpholine
CID 58031133

Frequently Asked Questions

What is the IUPAC name of 4-morpholin-4-ium-4-ylmorpholine?
The IUPAC name of 4-morpholin-4-ium-4-ylmorpholine (CID 154404125) is 4-morpholin-4-ium-4-ylmorpholine.
What is the SMILES notation for 4-morpholin-4-ium-4-ylmorpholine?
The canonical SMILES for 4-morpholin-4-ium-4-ylmorpholine is C1CN([NH+]2CCOCC2)CCO1.
What is the InChIKey of 4-morpholin-4-ium-4-ylmorpholine?
The InChIKey is BOQWOOLSORMISR-UHFFFAOYSA-O. The full InChI is InChI=1S/C8H16N2O2/c1-5-11-6-2-9(1)10-3-7-12-8-4-10/h1-8H2/p+1.
What are the key properties of 4-morpholin-4-ium-4-ylmorpholine?
4-morpholin-4-ium-4-ylmorpholine has a molecular weight of 173.24 g/mol, XLogP of -1.85, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-4-ium-4-ylmorpholine is sourced from PubChem (CID 154404125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).