2-(2-methoxyethyl)-1H-pyridazine-3,6-dione

C7H10N2O3 — CID 138715540

IUPAC2-(2-methoxyethyl)-1H-pyridazine-3,6-dione
SMILESCOCCn1[nH]c(=O)ccc1=O
InChIInChI=1S/C7H10N2O3/c1-12-5-4-9-7(11)3-2-6(10)8-9/h2-3H,4-5H2,1H3,(H,8,10)
InChIKeyWDMRTQVYNDSNPQ-UHFFFAOYSA-N
MW170.17 g/mol
LogP-0.82
Rot. Bonds3

About 2-(2-methoxyethyl)-1H-pyridazine-3,6-dione

2-(2-methoxyethyl)-1H-pyridazine-3,6-dione (PubChem CID 138715540) has the molecular formula C7H10N2O3 and a molecular weight of 170.17 g/mol. Its IUPAC name is 2-(2-methoxyethyl)-1H-pyridazine-3,6-dione.

Molecular Properties

Compound Name2-(2-methoxyethyl)-1H-pyridazine-3,6-dione
PubChem CID138715540
Molecular FormulaC7H10N2O3
Molecular Weight170.17 g/mol
Exact Mass170.07
IUPAC Name2-(2-methoxyethyl)-1H-pyridazine-3,6-dione
SMILESCOCCn1[nH]c(=O)ccc1=O
InChIInChI=1S/C7H10N2O3/c1-12-5-4-9-7(11)3-2-6(10)8-9/h2-3H,4-5H2,1H3,(H,8,10)
InChIKeyWDMRTQVYNDSNPQ-UHFFFAOYSA-N
XLogP-0.82
TPSA64.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.17
LogP ≤ 5-0.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-Hydroxy-2-(2-hydroxyethyl)-2,3-dihydropyridazin-3-one
CID 228461
1-(Prop-2-en-1-yl)-1,2-dihydropyridazine-3,6-dione
CID 12843593
4-Acryloylaminomorpholine
CID 23287323
ethyl 2-(3,6-dioxo-1H-pyridazin-2-yl)acetate
CID 28888360
Methyl 2-(3,6-dioxo-1,2-dihydropyridazinyl)acetate
CID 3375754
1-{2-[(2-Methoxy-1-methylethyl)amino]ethyl}-1,2-dihydropyridazine-3,6-dione
CID 50961301
6-hydroxy-2-isopropyl-3(2H)-pyridazinone
CID 11378616
2-ethyl-1H-pyridazine-3,6-dione
CID 12289925
N-(2-methoxyethyl)-N'-methylprop-2-enehydrazide
CID 134398638
(Z)-4-[amino(ethyl)amino]-4-oxobut-2-enamide
CID 140357016
2-[2-(2-chloroethoxy)ethyl]-1H-pyridazine-3,6-dione
CID 15314089
2-(oxiran-2-ylmethyl)-1H-pyridazine-3,6-dione
CID 16785259

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethyl)-1H-pyridazine-3,6-dione?
The IUPAC name of 2-(2-methoxyethyl)-1H-pyridazine-3,6-dione (CID 138715540) is 2-(2-methoxyethyl)-1H-pyridazine-3,6-dione.
What is the SMILES notation for 2-(2-methoxyethyl)-1H-pyridazine-3,6-dione?
The canonical SMILES for 2-(2-methoxyethyl)-1H-pyridazine-3,6-dione is COCCn1[nH]c(=O)ccc1=O.
What is the InChIKey of 2-(2-methoxyethyl)-1H-pyridazine-3,6-dione?
The InChIKey is WDMRTQVYNDSNPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O3/c1-12-5-4-9-7(11)3-2-6(10)8-9/h2-3H,4-5H2,1H3,(H,8,10).
What are the key properties of 2-(2-methoxyethyl)-1H-pyridazine-3,6-dione?
2-(2-methoxyethyl)-1H-pyridazine-3,6-dione has a molecular weight of 170.17 g/mol, XLogP of -0.82, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethyl)-1H-pyridazine-3,6-dione is sourced from PubChem (CID 138715540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).