2-(5-amino-6-methoxypyridazin-3-yl)ethanol

C7H11N3O2 — CID 117104987

IUPAC2-(5-amino-6-methoxypyridazin-3-yl)ethanol
SMILESCOc1nnc(CCO)cc1N
InChIInChI=1S/C7H11N3O2/c1-12-7-6(8)4-5(2-3-11)9-10-7/h4,11H,2-3H2,1H3,(H2,8,9)
InChIKeyAYKJOHUIRBPPRB-UHFFFAOYSA-N
MW169.18 g/mol
LogP-0.40
Rot. Bonds3

About 2-(5-amino-6-methoxypyridazin-3-yl)ethanol

2-(5-amino-6-methoxypyridazin-3-yl)ethanol (PubChem CID 117104987) has the molecular formula C7H11N3O2 and a molecular weight of 169.18 g/mol. Its IUPAC name is 2-(5-amino-6-methoxypyridazin-3-yl)ethanol.

Molecular Properties

Compound Name2-(5-amino-6-methoxypyridazin-3-yl)ethanol
PubChem CID117104987
Molecular FormulaC7H11N3O2
Molecular Weight169.18 g/mol
Exact Mass169.09
IUPAC Name2-(5-amino-6-methoxypyridazin-3-yl)ethanol
SMILESCOc1nnc(CCO)cc1N
InChIInChI=1S/C7H11N3O2/c1-12-7-6(8)4-5(2-3-11)9-10-7/h4,11H,2-3H2,1H3,(H2,8,9)
InChIKeyAYKJOHUIRBPPRB-UHFFFAOYSA-N
XLogP-0.40
TPSA81.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.18
LogP ≤ 5-0.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-6-methoxypyridazin-3-yl)ethanol?
The IUPAC name of 2-(5-amino-6-methoxypyridazin-3-yl)ethanol (CID 117104987) is 2-(5-amino-6-methoxypyridazin-3-yl)ethanol.
What is the SMILES notation for 2-(5-amino-6-methoxypyridazin-3-yl)ethanol?
The canonical SMILES for 2-(5-amino-6-methoxypyridazin-3-yl)ethanol is COc1nnc(CCO)cc1N.
What is the InChIKey of 2-(5-amino-6-methoxypyridazin-3-yl)ethanol?
The InChIKey is AYKJOHUIRBPPRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O2/c1-12-7-6(8)4-5(2-3-11)9-10-7/h4,11H,2-3H2,1H3,(H2,8,9).
What are the key properties of 2-(5-amino-6-methoxypyridazin-3-yl)ethanol?
2-(5-amino-6-methoxypyridazin-3-yl)ethanol has a molecular weight of 169.18 g/mol, XLogP of -0.40, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-6-methoxypyridazin-3-yl)ethanol is sourced from PubChem (CID 117104987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).