2-phenyl-1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone

C18H20N2O2 — CID 71798620

IUPAC2-phenyl-1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone
SMILESO=C(Cc1ccccc1)N1CCC(Oc2ccccn2)CC1
InChIInChI=1S/C18H20N2O2/c21-18(14-15-6-2-1-3-7-15)20-12-9-16(10-13-20)22-17-8-4-5-11-19-17/h1-8,11,16H,9-10,12-14H2
InChIKeyDJIFEARFVXHAHL-UHFFFAOYSA-N
MW296.37 g/mol
LogP2.69
Rot. Bonds4

About 2-phenyl-1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone

2-phenyl-1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone (PubChem CID 71798620) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is 2-phenyl-1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone.

Molecular Properties

Compound Name2-phenyl-1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone
PubChem CID71798620
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC Name2-phenyl-1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone
SMILESO=C(Cc1ccccc1)N1CCC(Oc2ccccn2)CC1
InChIInChI=1S/C18H20N2O2/c21-18(14-15-6-2-1-3-7-15)20-12-9-16(10-13-20)22-17-8-4-5-11-19-17/h1-8,11,16H,9-10,12-14H2
InChIKeyDJIFEARFVXHAHL-UHFFFAOYSA-N
XLogP2.69
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone
CID 71798593
2-ethoxy-1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone
CID 71798598
1-[4-(5-fluoropyrimidin-2-yl)oxypiperidin-1-yl]-2-phenylethanone
CID 139023328
2-(4-fluorophenyl)-1-(3-pyridin-2-yloxyazetidin-1-yl)ethanone
CID 122247174
1-[4-[[5-(morpholine-4-carbonyl)-2-pyridinyl]oxy]piperidin-1-yl]-2-phenylethanone
CID 91914135
1-[4-(4-fluorophenoxy)piperidin-1-yl]-2-phenylethanone
CID 110396939
2-(4-chlorophenyl)-1-(4-pyrimidin-4-yloxypiperidin-1-yl)ethanone
CID 121161917
2-(4-chlorophenyl)-1-(4-pyridazin-3-yloxypiperidin-1-yl)ethanone
CID 90559291
2-(4-fluorophenyl)-1-(4-pyrazin-2-yloxypiperidin-1-yl)ethanone
CID 90559036
3,3,3-trifluoro-1-[(3R)-3-pyridin-2-yloxypyrrolidin-1-yl]propan-1-one
CID 129417057
2-phenoxy-1-(4-pyridin-2-yloxypiperidin-1-yl)propan-1-one
CID 71798614
1-[4-(6-methylpyridazin-3-yl)oxypiperidin-1-yl]-2-(4-phenylphenyl)ethanone
CID 90559617

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone?
The IUPAC name of 2-phenyl-1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone (CID 71798620) is 2-phenyl-1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone.
What is the SMILES notation for 2-phenyl-1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone?
The canonical SMILES for 2-phenyl-1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone is O=C(Cc1ccccc1)N1CCC(Oc2ccccn2)CC1.
What is the InChIKey of 2-phenyl-1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone?
The InChIKey is DJIFEARFVXHAHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2/c21-18(14-15-6-2-1-3-7-15)20-12-9-16(10-13-20)22-17-8-4-5-11-19-17/h1-8,11,16H,9-10,12-14H2.
What are the key properties of 2-phenyl-1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone?
2-phenyl-1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone has a molecular weight of 296.37 g/mol, XLogP of 2.69, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone is sourced from PubChem (CID 71798620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).