3-[6-(1-cyclopentylpiperidin-4-yl)oxy-3-pyridinyl]-1H-pyridazin-6-one

C19H24N4O2 — CID 24992520

IUPAC3-[6-(1-cyclopentylpiperidin-4-yl)oxy-3-pyridinyl]-1H-pyridazin-6-one
SMILESO=c1ccc(-c2ccc(OC3CCN(C4CCCC4)CC3)nc2)n[nH]1
InChIInChI=1S/C19H24N4O2/c24-18-7-6-17(21-22-18)14-5-8-19(20-13-14)25-16-9-11-23(12-10-16)15-3-1-2-4-15/h5-8,13,15-16H,1-4,9-12H2,(H,22,24)
InChIKeyJOPFWTSKQSHMGB-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.62
Rot. Bonds4

About 3-[6-(1-cyclopentylpiperidin-4-yl)oxy-3-pyridinyl]-1H-pyridazin-6-one

3-[6-(1-cyclopentylpiperidin-4-yl)oxy-3-pyridinyl]-1H-pyridazin-6-one (PubChem CID 24992520) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 3-[6-(1-cyclopentylpiperidin-4-yl)oxy-3-pyridinyl]-1H-pyridazin-6-one.

Molecular Properties

Compound Name3-[6-(1-cyclopentylpiperidin-4-yl)oxy-3-pyridinyl]-1H-pyridazin-6-one
PubChem CID24992520
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name3-[6-(1-cyclopentylpiperidin-4-yl)oxy-3-pyridinyl]-1H-pyridazin-6-one
SMILESO=c1ccc(-c2ccc(OC3CCN(C4CCCC4)CC3)nc2)n[nH]1
InChIInChI=1S/C19H24N4O2/c24-18-7-6-17(21-22-18)14-5-8-19(20-13-14)25-16-9-11-23(12-10-16)15-3-1-2-4-15/h5-8,13,15-16H,1-4,9-12H2,(H,22,24)
InChIKeyJOPFWTSKQSHMGB-UHFFFAOYSA-N
XLogP2.62
TPSA71.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[6-(1-cyclobutylpiperidin-4-yl)oxy-3-pyridinyl]-1H-pyridazin-6-one
CID 24992189
3-[6-(1-cyclobutylpiperidin-4-yl)oxy-3-pyridinyl]-1H-pyridazin-6-one
CID 24992849
3-[6-(1-propan-2-ylpiperidin-4-yl)oxy-3-pyridinyl]-1H-pyridazin-6-one
CID 24992850
6-[6-(1-Cyclopentylpiperidin-4-yl)oxy-3-pyridinyl]-2-methylpyridazin-3-one
CID 24992851
6-[6-(1-Cyclobutylpiperidin-4-yl)oxy-3-pyridinyl]-2-methylpyridazin-3-one
CID 24992852
6-[6-(1-Cyclobutylpiperidin-4-yl)oxy-3-pyridinyl]-2-propan-2-ylpyridazin-3-one
CID 24992853
3-[6-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]-3-pyridinyl]-1H-pyridazin-6-one
CID 24992854
3-[6-(1-Cyclobutylpiperidin-4-yl)oxy-3-pyridinyl]-5,5-dimethyl-1,4-dihydropyridazin-6-one
CID 24993174
6-{4-[3-((R)-2-Methyl-pyrrolidin-1-yl)-propoxy]-phenyl}-4-pyridin-2-yl-2H-pyridazin-3-one
CID 24994744
3-[4-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]phenyl]-4-pyridin-2-yl-1H-pyridazin-6-one
CID 24996966
2-[[(1S,5R)-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl]oxy]pyridine-4-carboxamide
CID 49865860
6-oxo-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]-1H-pyridazine-3-carboxamide
CID 45827504

Frequently Asked Questions

What is the IUPAC name of 3-[6-(1-cyclopentylpiperidin-4-yl)oxy-3-pyridinyl]-1H-pyridazin-6-one?
The IUPAC name of 3-[6-(1-cyclopentylpiperidin-4-yl)oxy-3-pyridinyl]-1H-pyridazin-6-one (CID 24992520) is 3-[6-(1-cyclopentylpiperidin-4-yl)oxy-3-pyridinyl]-1H-pyridazin-6-one.
What is the SMILES notation for 3-[6-(1-cyclopentylpiperidin-4-yl)oxy-3-pyridinyl]-1H-pyridazin-6-one?
The canonical SMILES for 3-[6-(1-cyclopentylpiperidin-4-yl)oxy-3-pyridinyl]-1H-pyridazin-6-one is O=c1ccc(-c2ccc(OC3CCN(C4CCCC4)CC3)nc2)n[nH]1.
What is the InChIKey of 3-[6-(1-cyclopentylpiperidin-4-yl)oxy-3-pyridinyl]-1H-pyridazin-6-one?
The InChIKey is JOPFWTSKQSHMGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c24-18-7-6-17(21-22-18)14-5-8-19(20-13-14)25-16-9-11-23(12-10-16)15-3-1-2-4-15/h5-8,13,15-16H,1-4,9-12H2,(H,22,24).
What are the key properties of 3-[6-(1-cyclopentylpiperidin-4-yl)oxy-3-pyridinyl]-1H-pyridazin-6-one?
3-[6-(1-cyclopentylpiperidin-4-yl)oxy-3-pyridinyl]-1H-pyridazin-6-one has a molecular weight of 340.43 g/mol, XLogP of 2.62, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[6-(1-cyclopentylpiperidin-4-yl)oxy-3-pyridinyl]-1H-pyridazin-6-one is sourced from PubChem (CID 24992520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).