furan-3-yl-[(3R)-3-pyridazin-3-yloxypiperidin-1-yl]methanone

C14H15N3O3 — CID 100639672

IUPACfuran-3-yl-[(3R)-3-pyridazin-3-yloxypiperidin-1-yl]methanone
SMILESO=C(c1ccoc1)N1CCC[C@@H](Oc2cccnn2)C1
InChIInChI=1S/C14H15N3O3/c18-14(11-5-8-19-10-11)17-7-2-3-12(9-17)20-13-4-1-6-15-16-13/h1,4-6,8,10,12H,2-3,7,9H2/t12-/m1/s1
InChIKeyKPDFXTBYQBCIDL-GFCCVEGCSA-N
MW273.29 g/mol
LogP1.75
Rot. Bonds3

About furan-3-yl-[(3R)-3-pyridazin-3-yloxypiperidin-1-yl]methanone

furan-3-yl-[(3R)-3-pyridazin-3-yloxypiperidin-1-yl]methanone (PubChem CID 100639672) has the molecular formula C14H15N3O3 and a molecular weight of 273.29 g/mol. Its IUPAC name is furan-3-yl-[(3R)-3-pyridazin-3-yloxypiperidin-1-yl]methanone.

Molecular Properties

Compound Namefuran-3-yl-[(3R)-3-pyridazin-3-yloxypiperidin-1-yl]methanone
PubChem CID100639672
Molecular FormulaC14H15N3O3
Molecular Weight273.29 g/mol
Exact Mass273.11
IUPAC Namefuran-3-yl-[(3R)-3-pyridazin-3-yloxypiperidin-1-yl]methanone
SMILESO=C(c1ccoc1)N1CCC[C@@H](Oc2cccnn2)C1
InChIInChI=1S/C14H15N3O3/c18-14(11-5-8-19-10-11)17-7-2-3-12(9-17)20-13-4-1-6-15-16-13/h1,4-6,8,10,12H,2-3,7,9H2/t12-/m1/s1
InChIKeyKPDFXTBYQBCIDL-GFCCVEGCSA-N
XLogP1.75
TPSA68.46 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(4-methylphenyl)-[(3S)-3-pyridazin-3-yloxypiperidin-1-yl]methanone
CID 100638429
furan-3-yl-[(3R)-3-(6-methylpyridazin-3-yl)oxypiperidin-1-yl]methanone
CID 100642616
5-(3-pyridazin-3-yloxypiperidine-1-carbonyl)-1H-pyridin-2-one
CID 91627644
(2,5-dimethylfuran-3-yl)-[(3R)-3-pyridazin-3-yloxypiperidin-1-yl]methanone
CID 100638902
(2,5-dimethylfuran-3-yl)-(3-pyridazin-3-yloxypiperidin-1-yl)methanone
CID 91627673
2-cyclopentyl-1-[(3S)-3-pyridazin-3-yloxypiperidin-1-yl]ethanone
CID 100638394
(4-phenylphenyl)-(3-pyridazin-3-yloxypyrrolidin-1-yl)methanone
CID 90638273
(2,4-dimethyl-1,3-thiazol-5-yl)-(3-pyridazin-3-yloxypiperidin-1-yl)methanone
CID 91627672
1-[4-[(3R)-3-pyridazin-3-yloxypiperidine-1-carbonyl]piperidin-1-yl]ethanone
CID 100638372
[3-(5-bromopyrimidin-2-yl)oxypiperidin-1-yl]-(furan-3-yl)methanone
CID 122258964
1,3-benzothiazol-2-yl-(3-pyridazin-3-yloxypiperidin-1-yl)methanone
CID 91627678
(3-methoxy-1-methylpyrazol-4-yl)-[(3R)-3-pyridazin-3-yloxypiperidin-1-yl]methanone
CID 100639162

Frequently Asked Questions

What is the IUPAC name of furan-3-yl-[(3R)-3-pyridazin-3-yloxypiperidin-1-yl]methanone?
The IUPAC name of furan-3-yl-[(3R)-3-pyridazin-3-yloxypiperidin-1-yl]methanone (CID 100639672) is furan-3-yl-[(3R)-3-pyridazin-3-yloxypiperidin-1-yl]methanone.
What is the SMILES notation for furan-3-yl-[(3R)-3-pyridazin-3-yloxypiperidin-1-yl]methanone?
The canonical SMILES for furan-3-yl-[(3R)-3-pyridazin-3-yloxypiperidin-1-yl]methanone is O=C(c1ccoc1)N1CCC[C@@H](Oc2cccnn2)C1.
What is the InChIKey of furan-3-yl-[(3R)-3-pyridazin-3-yloxypiperidin-1-yl]methanone?
The InChIKey is KPDFXTBYQBCIDL-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H15N3O3/c18-14(11-5-8-19-10-11)17-7-2-3-12(9-17)20-13-4-1-6-15-16-13/h1,4-6,8,10,12H,2-3,7,9H2/t12-/m1/s1.
What are the key properties of furan-3-yl-[(3R)-3-pyridazin-3-yloxypiperidin-1-yl]methanone?
furan-3-yl-[(3R)-3-pyridazin-3-yloxypiperidin-1-yl]methanone has a molecular weight of 273.29 g/mol, XLogP of 1.75, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for furan-3-yl-[(3R)-3-pyridazin-3-yloxypiperidin-1-yl]methanone is sourced from PubChem (CID 100639672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).