2-[2-methoxyethyl(pyridazin-3-yl)amino]ethanol

C9H15N3O2 — CID 115672575

IUPAC2-[2-methoxyethyl(pyridazin-3-yl)amino]ethanol
SMILESCOCCN(CCO)c1cccnn1
InChIInChI=1S/C9H15N3O2/c1-14-8-6-12(5-7-13)9-3-2-4-10-11-9/h2-4,13H,5-8H2,1H3
InChIKeySKJLXPMCIICDBF-UHFFFAOYSA-N
MW197.24 g/mol
LogP-0.08
Rot. Bonds6

About 2-[2-methoxyethyl(pyridazin-3-yl)amino]ethanol

2-[2-methoxyethyl(pyridazin-3-yl)amino]ethanol (PubChem CID 115672575) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is 2-[2-methoxyethyl(pyridazin-3-yl)amino]ethanol.

Molecular Properties

Compound Name2-[2-methoxyethyl(pyridazin-3-yl)amino]ethanol
PubChem CID115672575
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC Name2-[2-methoxyethyl(pyridazin-3-yl)amino]ethanol
SMILESCOCCN(CCO)c1cccnn1
InChIInChI=1S/C9H15N3O2/c1-14-8-6-12(5-7-13)9-3-2-4-10-11-9/h2-4,13H,5-8H2,1H3
InChIKeySKJLXPMCIICDBF-UHFFFAOYSA-N
XLogP-0.08
TPSA58.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 5-0.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[2-methoxyethyl(pyridazin-3-yl)amino]ethanol?
The IUPAC name of 2-[2-methoxyethyl(pyridazin-3-yl)amino]ethanol (CID 115672575) is 2-[2-methoxyethyl(pyridazin-3-yl)amino]ethanol.
What is the SMILES notation for 2-[2-methoxyethyl(pyridazin-3-yl)amino]ethanol?
The canonical SMILES for 2-[2-methoxyethyl(pyridazin-3-yl)amino]ethanol is COCCN(CCO)c1cccnn1.
What is the InChIKey of 2-[2-methoxyethyl(pyridazin-3-yl)amino]ethanol?
The InChIKey is SKJLXPMCIICDBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2/c1-14-8-6-12(5-7-13)9-3-2-4-10-11-9/h2-4,13H,5-8H2,1H3.
What are the key properties of 2-[2-methoxyethyl(pyridazin-3-yl)amino]ethanol?
2-[2-methoxyethyl(pyridazin-3-yl)amino]ethanol has a molecular weight of 197.24 g/mol, XLogP of -0.08, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methoxyethyl(pyridazin-3-yl)amino]ethanol is sourced from PubChem (CID 115672575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).