6-(oxolan-3-yloxy)pyridazine-3-carboxylic acid

C9H10N2O4 — CID 63557225

IUPAC6-(oxolan-3-yloxy)pyridazine-3-carboxylic acid
SMILESO=C(O)c1ccc(OC2CCOC2)nn1
InChIInChI=1S/C9H10N2O4/c12-9(13)7-1-2-8(11-10-7)15-6-3-4-14-5-6/h1-2,6H,3-5H2,(H,12,13)
InChIKeyHXPKDKBCVUJROQ-UHFFFAOYSA-N
MW210.19 g/mol
LogP0.34
Rot. Bonds3

About 6-(oxolan-3-yloxy)pyridazine-3-carboxylic acid

6-(oxolan-3-yloxy)pyridazine-3-carboxylic acid (PubChem CID 63557225) has the molecular formula C9H10N2O4 and a molecular weight of 210.19 g/mol. Its IUPAC name is 6-(oxolan-3-yloxy)pyridazine-3-carboxylic acid.

Molecular Properties

Compound Name6-(oxolan-3-yloxy)pyridazine-3-carboxylic acid
PubChem CID63557225
Molecular FormulaC9H10N2O4
Molecular Weight210.19 g/mol
Exact Mass210.06
IUPAC Name6-(oxolan-3-yloxy)pyridazine-3-carboxylic acid
SMILESO=C(O)c1ccc(OC2CCOC2)nn1
InChIInChI=1S/C9H10N2O4/c12-9(13)7-1-2-8(11-10-7)15-6-3-4-14-5-6/h1-2,6H,3-5H2,(H,12,13)
InChIKeyHXPKDKBCVUJROQ-UHFFFAOYSA-N
XLogP0.34
TPSA81.54 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.19
LogP ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-iodo-6-[(3R)-oxolan-3-yl]oxypyridazine
CID 59277501
6-spiro[3.5]nonan-2-yloxypyridazine-3-carboxylic acid
CID 176985592
4-(oxolan-3-yloxy)pyridine-2-carboxylic acid
CID 63556832
2-(oxolan-3-yloxy)pyridine-4-carboxylic acid
CID 63559237
4-[(3R)-oxolan-3-yl]oxybenzoic acid
CID 95979365
N-tert-butyl-6-(oxolan-3-yloxy)pyridazin-3-amine
CID 138648782
oxolan-3-yl 6-chloropyridazine-3-carboxylate
CID 63839685
3-amino-2-(oxolan-3-yloxy)benzoic acid
CID 84688179
1-[5-(oxolan-3-yloxy)-2-pyridinyl]ethanone
CID 83119185
5-(oxan-4-yloxy)pyridine-2-carboxylic acid
CID 66570796
6-(oxolan-3-yloxy)-N-phenylpyridine-3-carboxamide
CID 91815160
[3-(6-methoxypyridazin-3-yl)oxypyrrolidin-1-yl]-(oxolan-3-yl)methanone
CID 91627512

Frequently Asked Questions

What is the IUPAC name of 6-(oxolan-3-yloxy)pyridazine-3-carboxylic acid?
The IUPAC name of 6-(oxolan-3-yloxy)pyridazine-3-carboxylic acid (CID 63557225) is 6-(oxolan-3-yloxy)pyridazine-3-carboxylic acid.
What is the SMILES notation for 6-(oxolan-3-yloxy)pyridazine-3-carboxylic acid?
The canonical SMILES for 6-(oxolan-3-yloxy)pyridazine-3-carboxylic acid is O=C(O)c1ccc(OC2CCOC2)nn1.
What is the InChIKey of 6-(oxolan-3-yloxy)pyridazine-3-carboxylic acid?
The InChIKey is HXPKDKBCVUJROQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O4/c12-9(13)7-1-2-8(11-10-7)15-6-3-4-14-5-6/h1-2,6H,3-5H2,(H,12,13).
What are the key properties of 6-(oxolan-3-yloxy)pyridazine-3-carboxylic acid?
6-(oxolan-3-yloxy)pyridazine-3-carboxylic acid has a molecular weight of 210.19 g/mol, XLogP of 0.34, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(oxolan-3-yloxy)pyridazine-3-carboxylic acid is sourced from PubChem (CID 63557225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).