[6-(2-propoxyethoxy)pyridazin-3-yl]methanol

C10H16N2O3 — CID 63684568

IUPAC[6-(2-propoxyethoxy)pyridazin-3-yl]methanol
SMILESCCCOCCOc1ccc(CO)nn1
InChIInChI=1S/C10H16N2O3/c1-2-5-14-6-7-15-10-4-3-9(8-13)11-12-10/h3-4,13H,2,5-8H2,1H3
InChIKeyBIGQMHRVCLIUCQ-UHFFFAOYSA-N
MW212.25 g/mol
LogP0.77
Rot. Bonds7

About [6-(2-propoxyethoxy)pyridazin-3-yl]methanol

[6-(2-propoxyethoxy)pyridazin-3-yl]methanol (PubChem CID 63684568) has the molecular formula C10H16N2O3 and a molecular weight of 212.25 g/mol. Its IUPAC name is [6-(2-propoxyethoxy)pyridazin-3-yl]methanol.

Molecular Properties

Compound Name[6-(2-propoxyethoxy)pyridazin-3-yl]methanol
PubChem CID63684568
Molecular FormulaC10H16N2O3
Molecular Weight212.25 g/mol
Exact Mass212.12
IUPAC Name[6-(2-propoxyethoxy)pyridazin-3-yl]methanol
SMILESCCCOCCOc1ccc(CO)nn1
InChIInChI=1S/C10H16N2O3/c1-2-5-14-6-7-15-10-4-3-9(8-13)11-12-10/h3-4,13H,2,5-8H2,1H3
InChIKeyBIGQMHRVCLIUCQ-UHFFFAOYSA-N
XLogP0.77
TPSA64.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [6-(2-propoxyethoxy)pyridazin-3-yl]methanol?
The IUPAC name of [6-(2-propoxyethoxy)pyridazin-3-yl]methanol (CID 63684568) is [6-(2-propoxyethoxy)pyridazin-3-yl]methanol.
What is the SMILES notation for [6-(2-propoxyethoxy)pyridazin-3-yl]methanol?
The canonical SMILES for [6-(2-propoxyethoxy)pyridazin-3-yl]methanol is CCCOCCOc1ccc(CO)nn1.
What is the InChIKey of [6-(2-propoxyethoxy)pyridazin-3-yl]methanol?
The InChIKey is BIGQMHRVCLIUCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3/c1-2-5-14-6-7-15-10-4-3-9(8-13)11-12-10/h3-4,13H,2,5-8H2,1H3.
What are the key properties of [6-(2-propoxyethoxy)pyridazin-3-yl]methanol?
[6-(2-propoxyethoxy)pyridazin-3-yl]methanol has a molecular weight of 212.25 g/mol, XLogP of 0.77, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2-propoxyethoxy)pyridazin-3-yl]methanol is sourced from PubChem (CID 63684568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).