4-morpholin-4-yl-1,2-dihydropyridazine-3,6-dione

C8H11N3O3 — CID 154141975

IUPAC4-morpholin-4-yl-1,2-dihydropyridazine-3,6-dione
SMILESO=c1cc(N2CCOCC2)c(=O)[nH][nH]1
InChIInChI=1S/C8H11N3O3/c12-7-5-6(8(13)10-9-7)11-1-3-14-4-2-11/h5H,1-4H2,(H,9,12)(H,10,13)
InChIKeyXRRVXAVLICCQIG-UHFFFAOYSA-N
MW197.19 g/mol
LogP-1.10
Rot. Bonds1

About 4-morpholin-4-yl-1,2-dihydropyridazine-3,6-dione

4-morpholin-4-yl-1,2-dihydropyridazine-3,6-dione (PubChem CID 154141975) has the molecular formula C8H11N3O3 and a molecular weight of 197.19 g/mol. Its IUPAC name is 4-morpholin-4-yl-1,2-dihydropyridazine-3,6-dione.

Molecular Properties

Compound Name4-morpholin-4-yl-1,2-dihydropyridazine-3,6-dione
PubChem CID154141975
Molecular FormulaC8H11N3O3
Molecular Weight197.19 g/mol
Exact Mass197.08
IUPAC Name4-morpholin-4-yl-1,2-dihydropyridazine-3,6-dione
SMILESO=c1cc(N2CCOCC2)c(=O)[nH][nH]1
InChIInChI=1S/C8H11N3O3/c12-7-5-6(8(13)10-9-7)11-1-3-14-4-2-11/h5H,1-4H2,(H,9,12)(H,10,13)
InChIKeyXRRVXAVLICCQIG-UHFFFAOYSA-N
XLogP-1.10
TPSA78.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.19
LogP ≤ 5-1.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(Z)-3-morpholin-4-ylbut-2-enehydrazide
CID 22071979
2-methyl-5-(morpholine-4-carbonyl)-1H-pyrazol-3-one
CID 22118185
3-Morpholin-4-ylbut-2-enehydrazide
CID 54328018
5-(Morpholine-4-carbonyl)-1,2-dihydropyrazol-3-one
CID 57712978
5-Methyl-4-morpholin-4-yl-1,2-dihydropyrazol-3-one
CID 89850892
2-methyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-one
CID 118690658
3-[2-(2-morpholin-4-yl-2-oxoacetyl)hydrazinyl]-N,N-di(propan-2-yl)but-2-enamide
CID 4226185
2-(2-morpholin-4-yl-2-oxoethyl)-1H-pyridazine-3,6-dione
CID 60635736
2-(5-amino-2-oxo-1-pyridinyl)-N-morpholin-4-ylacetamide
CID 83013123
N-morpholin-4-yl-6-oxo-1H-pyridine-2-carboxamide
CID 108110156
5-(2,6-Dimethylmorpholine-4-carbonyl)-1,2-dihydropyrazol-3-one
CID 108466312
N-(2-morpholin-4-ylethyl)-5-oxo-1,2-dihydropyrazole-3-carboxamide
CID 112513814

Frequently Asked Questions

What is the IUPAC name of 4-morpholin-4-yl-1,2-dihydropyridazine-3,6-dione?
The IUPAC name of 4-morpholin-4-yl-1,2-dihydropyridazine-3,6-dione (CID 154141975) is 4-morpholin-4-yl-1,2-dihydropyridazine-3,6-dione.
What is the SMILES notation for 4-morpholin-4-yl-1,2-dihydropyridazine-3,6-dione?
The canonical SMILES for 4-morpholin-4-yl-1,2-dihydropyridazine-3,6-dione is O=c1cc(N2CCOCC2)c(=O)[nH][nH]1.
What is the InChIKey of 4-morpholin-4-yl-1,2-dihydropyridazine-3,6-dione?
The InChIKey is XRRVXAVLICCQIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O3/c12-7-5-6(8(13)10-9-7)11-1-3-14-4-2-11/h5H,1-4H2,(H,9,12)(H,10,13).
What are the key properties of 4-morpholin-4-yl-1,2-dihydropyridazine-3,6-dione?
4-morpholin-4-yl-1,2-dihydropyridazine-3,6-dione has a molecular weight of 197.19 g/mol, XLogP of -1.10, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-4-yl-1,2-dihydropyridazine-3,6-dione is sourced from PubChem (CID 154141975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).