(4-pyridazin-3-yloxypiperidin-1-yl)-pyridin-4-ylmethanone

C15H16N4O2 — CID 90559340

IUPAC(4-pyridazin-3-yloxypiperidin-1-yl)-pyridin-4-ylmethanone
SMILESO=C(c1ccncc1)N1CCC(Oc2cccnn2)CC1
InChIInChI=1S/C15H16N4O2/c20-15(12-3-8-16-9-4-12)19-10-5-13(6-11-19)21-14-2-1-7-17-18-14/h1-4,7-9,13H,5-6,10-11H2
InChIKeyUJLIZPPCQXSETN-UHFFFAOYSA-N
MW284.32 g/mol
LogP1.56
Rot. Bonds3

About (4-pyridazin-3-yloxypiperidin-1-yl)-pyridin-4-ylmethanone

(4-pyridazin-3-yloxypiperidin-1-yl)-pyridin-4-ylmethanone (PubChem CID 90559340) has the molecular formula C15H16N4O2 and a molecular weight of 284.32 g/mol. Its IUPAC name is (4-pyridazin-3-yloxypiperidin-1-yl)-pyridin-4-ylmethanone.

Molecular Properties

Compound Name(4-pyridazin-3-yloxypiperidin-1-yl)-pyridin-4-ylmethanone
PubChem CID90559340
Molecular FormulaC15H16N4O2
Molecular Weight284.32 g/mol
Exact Mass284.13
IUPAC Name(4-pyridazin-3-yloxypiperidin-1-yl)-pyridin-4-ylmethanone
SMILESO=C(c1ccncc1)N1CCC(Oc2cccnn2)CC1
InChIInChI=1S/C15H16N4O2/c20-15(12-3-8-16-9-4-12)19-10-5-13(6-11-19)21-14-2-1-7-17-18-14/h1-4,7-9,13H,5-6,10-11H2
InChIKeyUJLIZPPCQXSETN-UHFFFAOYSA-N
XLogP1.56
TPSA68.21 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(4-pyridazin-3-yloxypiperidine-1-carbonyl)phenyl]acetamide
CID 71799336
(4-phenylphenyl)-(3-pyridazin-3-yloxypyrrolidin-1-yl)methanone
CID 90638273
[3-(dimethylamino)phenyl]-(4-pyridazin-3-yloxypiperidin-1-yl)methanone
CID 90559348
pyridin-4-yl-(4-pyrimidin-2-yloxypiperidin-1-yl)methanone
CID 90558789
1-(3-pyridazin-3-yloxypyrrolidin-1-yl)ethanone
CID 90638196
(2-nitrophenyl)-(4-pyridazin-3-yloxypiperidin-1-yl)methanone
CID 90559259
(3-pyridazin-3-yloxypyrrolidin-1-yl)-thiophen-2-ylmethanone
CID 91627208
N,N-dimethyl-4-(3-pyridazin-3-yloxypyrrolidine-1-carbonyl)benzenesulfonamide
CID 90638303
(4-butoxyphenyl)-(3-pyridazin-3-yloxypyrrolidin-1-yl)methanone
CID 90638234
(4-methylphenyl)-[(3S)-3-pyridazin-3-yloxypiperidin-1-yl]methanone
CID 100638429
(3-phenyl-1H-pyrazol-5-yl)-(4-pyridazin-3-yloxypiperidin-1-yl)methanone
CID 71799334
2,2,2-trifluoro-1-(3-pyridazin-3-yloxypyrrolidin-1-yl)ethanone
CID 159511918

Frequently Asked Questions

What is the IUPAC name of (4-pyridazin-3-yloxypiperidin-1-yl)-pyridin-4-ylmethanone?
The IUPAC name of (4-pyridazin-3-yloxypiperidin-1-yl)-pyridin-4-ylmethanone (CID 90559340) is (4-pyridazin-3-yloxypiperidin-1-yl)-pyridin-4-ylmethanone.
What is the SMILES notation for (4-pyridazin-3-yloxypiperidin-1-yl)-pyridin-4-ylmethanone?
The canonical SMILES for (4-pyridazin-3-yloxypiperidin-1-yl)-pyridin-4-ylmethanone is O=C(c1ccncc1)N1CCC(Oc2cccnn2)CC1.
What is the InChIKey of (4-pyridazin-3-yloxypiperidin-1-yl)-pyridin-4-ylmethanone?
The InChIKey is UJLIZPPCQXSETN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O2/c20-15(12-3-8-16-9-4-12)19-10-5-13(6-11-19)21-14-2-1-7-17-18-14/h1-4,7-9,13H,5-6,10-11H2.
What are the key properties of (4-pyridazin-3-yloxypiperidin-1-yl)-pyridin-4-ylmethanone?
(4-pyridazin-3-yloxypiperidin-1-yl)-pyridin-4-ylmethanone has a molecular weight of 284.32 g/mol, XLogP of 1.56, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-pyridazin-3-yloxypiperidin-1-yl)-pyridin-4-ylmethanone is sourced from PubChem (CID 90559340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).