2-[2-(6-methylpyridazin-3-yl)oxyethoxy]ethanol

C9H14N2O3 — CID 86090620

IUPAC2-[2-(6-methylpyridazin-3-yl)oxyethoxy]ethanol
SMILESCc1ccc(OCCOCCO)nn1
InChIInChI=1S/C9H14N2O3/c1-8-2-3-9(11-10-8)14-7-6-13-5-4-12/h2-3,12H,4-7H2,1H3
InChIKeyYUVKYQSHESADGM-UHFFFAOYSA-N
MW198.22 g/mol
LogP0.17
Rot. Bonds6

About 2-[2-(6-methylpyridazin-3-yl)oxyethoxy]ethanol

2-[2-(6-methylpyridazin-3-yl)oxyethoxy]ethanol (PubChem CID 86090620) has the molecular formula C9H14N2O3 and a molecular weight of 198.22 g/mol. Its IUPAC name is 2-[2-(6-methylpyridazin-3-yl)oxyethoxy]ethanol.

Molecular Properties

Compound Name2-[2-(6-methylpyridazin-3-yl)oxyethoxy]ethanol
PubChem CID86090620
Molecular FormulaC9H14N2O3
Molecular Weight198.22 g/mol
Exact Mass198.10
IUPAC Name2-[2-(6-methylpyridazin-3-yl)oxyethoxy]ethanol
SMILESCc1ccc(OCCOCCO)nn1
InChIInChI=1S/C9H14N2O3/c1-8-2-3-9(11-10-8)14-7-6-13-5-4-12/h2-3,12H,4-7H2,1H3
InChIKeyYUVKYQSHESADGM-UHFFFAOYSA-N
XLogP0.17
TPSA64.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.22
LogP ≤ 50.17
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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Related Compounds

2-(6-methylpyridazin-3-yl)oxyethanamine
CID 62347567
[6-(2-propoxyethoxy)pyridazin-3-yl]methanol
CID 63684568
2-[2-[2-[(5-iodo-2-pyridinyl)oxy]ethoxy]ethoxy]ethanol
CID 56849565
2-[2-[2-(2-methoxyphenoxy)ethoxy]ethoxy]ethanol
CID 15049023
[6-(2-ethoxyethoxy)pyridazin-3-yl]methanol
CID 61255275
2-[6-(hydroxymethyl)pyridazin-3-yl]oxyethanol
CID 61256353
2-[2-(2-quinolin-2-yloxyethoxy)ethoxy]ethanol
CID 142628371
[6-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-3-pyridinyl]boronic acid
CID 140869715
2-[2-[2-[2-[2-[4-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 102253711
2-[2-[4,5,8-tris[2-(2-hydroxyethoxy)ethoxy]anthracen-1-yl]oxyethoxy]ethanol
CID 89126006
2-[2-(2-chloro-5-methylphenoxy)ethoxy]ethanol
CID 61075702
2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-4,5-dimethylphenoxy]ethoxy]ethoxy]ethanol
CID 59950660

Frequently Asked Questions

What is the IUPAC name of 2-[2-(6-methylpyridazin-3-yl)oxyethoxy]ethanol?
The IUPAC name of 2-[2-(6-methylpyridazin-3-yl)oxyethoxy]ethanol (CID 86090620) is 2-[2-(6-methylpyridazin-3-yl)oxyethoxy]ethanol.
What is the SMILES notation for 2-[2-(6-methylpyridazin-3-yl)oxyethoxy]ethanol?
The canonical SMILES for 2-[2-(6-methylpyridazin-3-yl)oxyethoxy]ethanol is Cc1ccc(OCCOCCO)nn1.
What is the InChIKey of 2-[2-(6-methylpyridazin-3-yl)oxyethoxy]ethanol?
The InChIKey is YUVKYQSHESADGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O3/c1-8-2-3-9(11-10-8)14-7-6-13-5-4-12/h2-3,12H,4-7H2,1H3.
What are the key properties of 2-[2-(6-methylpyridazin-3-yl)oxyethoxy]ethanol?
2-[2-(6-methylpyridazin-3-yl)oxyethoxy]ethanol has a molecular weight of 198.22 g/mol, XLogP of 0.17, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(6-methylpyridazin-3-yl)oxyethoxy]ethanol is sourced from PubChem (CID 86090620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).