6-Ethyl-3-(4-hydroxymethyl-1-piperidinyl)pyridazine

HCID 19797306

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Basic information

CAS: 152665-27-5
Standard SMILES: CCc1ccc(N2CCC(CO)CC2)nn1
InChIKey: YKUOMFHOHPYKDX-UHFFFAOYSA-N
Molecular formula: C12H19N3O
Average molar mass: 221.3 g/mol
Monoisotopic mass: 221.15281223

Names & identifiers

Preferred name: 6-Ethyl-3-(4-hydroxymethyl-1-piperidinyl)pyridazine
IUPAC: [1-(6-ethylpyridazin-3-yl)piperidin-4-yl]methanol

Names & synonyms

SCHEMBL4582106-ethyl-3-(4-hydroxymethyl-1-piperidinyl)pyridazineYKUOMFHOHPYKDX-UHFFFAOYSA-NDTXSID101248618152665-27-51-(6-Ethyl-3-pyridazinyl)-4-piperidinemethanol[1-(6-ethylpyridazin-3-yl)piperidin-4-yl]methanol

Database identifiers

CAS: 152665-27-5
PubChem CID: 19797306
DTXSID: DTXSID101248618

Properties

Computed structural properties

XLogP: 1.2
Topological polar surface area: 49.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 3
Heavy atoms: 16
Formal charge: 0
Complexity: 204

Related reactions

1 records

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HRID 4942As productuspto-grants-1993_09

Compound notes

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