1-morpholin-4-yl-2-piperazin-1-ylethane-1,2-dione

C10H17N3O3 — CID 7131953

IUPAC1-morpholin-4-yl-2-piperazin-1-ylethane-1,2-dione
SMILESO=C(C(=O)N1CCOCC1)N1CCNCC1
InChIInChI=1S/C10H17N3O3/c14-9(12-3-1-11-2-4-12)10(15)13-5-7-16-8-6-13/h11H,1-8H2
InChIKeyXHWMCHIHVJSGRA-UHFFFAOYSA-N
MW227.26 g/mol
LogP-1.72
Rot. Bonds

About 1-morpholin-4-yl-2-piperazin-1-ylethane-1,2-dione

1-morpholin-4-yl-2-piperazin-1-ylethane-1,2-dione (PubChem CID 7131953) has the molecular formula C10H17N3O3 and a molecular weight of 227.26 g/mol. Its IUPAC name is 1-morpholin-4-yl-2-piperazin-1-ylethane-1,2-dione.

Molecular Properties

Compound Name1-morpholin-4-yl-2-piperazin-1-ylethane-1,2-dione
PubChem CID7131953
Molecular FormulaC10H17N3O3
Molecular Weight227.26 g/mol
Exact Mass227.13
IUPAC Name1-morpholin-4-yl-2-piperazin-1-ylethane-1,2-dione
SMILESO=C(C(=O)N1CCOCC1)N1CCNCC1
InChIInChI=1S/C10H17N3O3/c14-9(12-3-1-11-2-4-12)10(15)13-5-7-16-8-6-13/h11H,1-8H2
InChIKeyXHWMCHIHVJSGRA-UHFFFAOYSA-N
XLogP-1.72
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 5-1.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-(azetidin-1-yl)-2-piperazin-1-ylethane-1,2-dione
CID 130547937
2,3-dimethyl-1-morpholin-4-yl-4-piperazin-1-ylbutane-1,4-dione
CID 173096762
2-oxo-2-piperazin-1-ylacetic acid
CID 2050152
1-(4-acetylpiperazin-1-yl)-2-piperazin-1-ylethane-1,2-dione
CID 28507184
1-morpholin-4-yl-3-piperazin-1-ylpropan-1-one;dihydrochloride
CID 53415361
3,3-dimorpholin-4-yl-1-piperazin-1-ylpropan-1-one
CID 175463060
1-morpholin-4-yl-2-piperazin-1-ylpropan-1-one;dihydrochloride
CID 50988307
(4-aminooxan-4-yl)-piperazin-1-ylmethanone
CID 115293706
1-(4-hydroxy-4-methylpiperidin-1-yl)-2-piperazin-1-ylethane-1,2-dione
CID 81115688
1-(2-methyl-1,4-oxazepan-4-yl)-2-piperazin-1-ylethane-1,2-dione
CID 55141735
2-chloro-1-(1,6-dioxa-3,9-diazacycloundec-3-yl)ethanone
CID 167204900
4-piperazin-1-ylmorpholine
CID 2760466

Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-2-piperazin-1-ylethane-1,2-dione?
The IUPAC name of 1-morpholin-4-yl-2-piperazin-1-ylethane-1,2-dione (CID 7131953) is 1-morpholin-4-yl-2-piperazin-1-ylethane-1,2-dione.
What is the SMILES notation for 1-morpholin-4-yl-2-piperazin-1-ylethane-1,2-dione?
The canonical SMILES for 1-morpholin-4-yl-2-piperazin-1-ylethane-1,2-dione is O=C(C(=O)N1CCOCC1)N1CCNCC1.
What is the InChIKey of 1-morpholin-4-yl-2-piperazin-1-ylethane-1,2-dione?
The InChIKey is XHWMCHIHVJSGRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3/c14-9(12-3-1-11-2-4-12)10(15)13-5-7-16-8-6-13/h11H,1-8H2.
What are the key properties of 1-morpholin-4-yl-2-piperazin-1-ylethane-1,2-dione?
1-morpholin-4-yl-2-piperazin-1-ylethane-1,2-dione has a molecular weight of 227.26 g/mol, XLogP of -1.72, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-2-piperazin-1-ylethane-1,2-dione is sourced from PubChem (CID 7131953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).