6-[6-(1-cyclobutylpiperidin-4-yl)oxy-3-pyridinyl]-2-methylpyridazin-3-one

C19H24N4O2 — CID 24992852

IUPAC6-[6-(1-cyclobutylpiperidin-4-yl)oxy-3-pyridinyl]-2-methylpyridazin-3-one
SMILESCn1nc(-c2ccc(OC3CCN(C4CCC4)CC3)nc2)ccc1=O
InChIInChI=1S/C19H24N4O2/c1-22-19(24)8-6-17(21-22)14-5-7-18(20-13-14)25-16-9-11-23(12-10-16)15-3-2-4-15/h5-8,13,15-16H,2-4,9-12H2,1H3
InChIKeyCRMSINMAJOZLNY-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.24
Rot. Bonds4

About 6-[6-(1-cyclobutylpiperidin-4-yl)oxy-3-pyridinyl]-2-methylpyridazin-3-one

6-[6-(1-cyclobutylpiperidin-4-yl)oxy-3-pyridinyl]-2-methylpyridazin-3-one (PubChem CID 24992852) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 6-[6-(1-cyclobutylpiperidin-4-yl)oxy-3-pyridinyl]-2-methylpyridazin-3-one.

Molecular Properties

Compound Name6-[6-(1-cyclobutylpiperidin-4-yl)oxy-3-pyridinyl]-2-methylpyridazin-3-one
PubChem CID24992852
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name6-[6-(1-cyclobutylpiperidin-4-yl)oxy-3-pyridinyl]-2-methylpyridazin-3-one
SMILESCn1nc(-c2ccc(OC3CCN(C4CCC4)CC3)nc2)ccc1=O
InChIInChI=1S/C19H24N4O2/c1-22-19(24)8-6-17(21-22)14-5-7-18(20-13-14)25-16-9-11-23(12-10-16)15-3-2-4-15/h5-8,13,15-16H,2-4,9-12H2,1H3
InChIKeyCRMSINMAJOZLNY-UHFFFAOYSA-N
XLogP2.24
TPSA60.25 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-[6-(1-cyclobutylpiperidin-4-yl)oxy-3-pyridinyl]-2-methylpyridazin-3-one?
The IUPAC name of 6-[6-(1-cyclobutylpiperidin-4-yl)oxy-3-pyridinyl]-2-methylpyridazin-3-one (CID 24992852) is 6-[6-(1-cyclobutylpiperidin-4-yl)oxy-3-pyridinyl]-2-methylpyridazin-3-one.
What is the SMILES notation for 6-[6-(1-cyclobutylpiperidin-4-yl)oxy-3-pyridinyl]-2-methylpyridazin-3-one?
The canonical SMILES for 6-[6-(1-cyclobutylpiperidin-4-yl)oxy-3-pyridinyl]-2-methylpyridazin-3-one is Cn1nc(-c2ccc(OC3CCN(C4CCC4)CC3)nc2)ccc1=O.
What is the InChIKey of 6-[6-(1-cyclobutylpiperidin-4-yl)oxy-3-pyridinyl]-2-methylpyridazin-3-one?
The InChIKey is CRMSINMAJOZLNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-22-19(24)8-6-17(21-22)14-5-7-18(20-13-14)25-16-9-11-23(12-10-16)15-3-2-4-15/h5-8,13,15-16H,2-4,9-12H2,1H3.
What are the key properties of 6-[6-(1-cyclobutylpiperidin-4-yl)oxy-3-pyridinyl]-2-methylpyridazin-3-one?
6-[6-(1-cyclobutylpiperidin-4-yl)oxy-3-pyridinyl]-2-methylpyridazin-3-one has a molecular weight of 340.43 g/mol, XLogP of 2.24, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[6-(1-cyclobutylpiperidin-4-yl)oxy-3-pyridinyl]-2-methylpyridazin-3-one is sourced from PubChem (CID 24992852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).