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

C12H16N2O2 — CID 71798593

IUPAC1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone
SMILESCC(=O)N1CCC(Oc2ccccn2)CC1
InChIInChI=1S/C12H16N2O2/c1-10(15)14-8-5-11(6-9-14)16-12-4-2-3-7-13-12/h2-4,7,11H,5-6,8-9H2,1H3
InChIKeyDIXXWEJRXYWBBH-UHFFFAOYSA-N
MW220.27 g/mol
LogP1.47
Rot. Bonds2

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

1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone (PubChem CID 71798593) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is 1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone.

Molecular Properties

Compound Name1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone
PubChem CID71798593
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC Name1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone
SMILESCC(=O)N1CCC(Oc2ccccn2)CC1
InChIInChI=1S/C12H16N2O2/c1-10(15)14-8-5-11(6-9-14)16-12-4-2-3-7-13-12/h2-4,7,11H,5-6,8-9H2,1H3
InChIKeyDIXXWEJRXYWBBH-UHFFFAOYSA-N
XLogP1.47
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethoxy-1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone
CID 71798598
2-phenyl-1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone
CID 71798620
2-phenoxy-1-(4-pyridin-2-yloxypiperidin-1-yl)propan-1-one
CID 71798614
(4S)-1-methyl-4-(4-pyridin-2-yloxypiperidine-1-carbonyl)pyrrolidin-2-one
CID 97104979
(4-tert-butylphenyl)-[(3S)-3-pyridin-2-yloxypyrrolidin-1-yl]methanone
CID 129417459
3-(4-pyridin-2-yloxypiperidine-1-carbonyl)-1H-pyridin-2-one
CID 71798576
5-(4-pyridin-2-yloxypiperidine-1-carbonyl)-1H-pyridin-2-one
CID 71798575
tert-butyl N-[2-oxo-2-(4-pyridin-2-yloxypiperidin-1-yl)ethyl]-N-pyridin-2-ylcarbamate
CID 22499456
(3,5-dimethoxyphenyl)-[(3R)-3-pyridin-2-yloxypyrrolidin-1-yl]methanone
CID 129417295
3,3,3-trifluoro-1-[(3R)-3-pyridin-2-yloxypyrrolidin-1-yl]propan-1-one
CID 129417057
1-(3-pyridazin-3-yloxypyrrolidin-1-yl)ethanone
CID 90638196
(3-phenyl-1H-pyrazol-5-yl)-(4-pyridin-2-yloxypiperidin-1-yl)methanone
CID 71798583

Frequently Asked Questions

What is the IUPAC name of 1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone?
The IUPAC name of 1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone (CID 71798593) is 1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone.
What is the SMILES notation for 1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone?
The canonical SMILES for 1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone is CC(=O)N1CCC(Oc2ccccn2)CC1.
What is the InChIKey of 1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone?
The InChIKey is DIXXWEJRXYWBBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-10(15)14-8-5-11(6-9-14)16-12-4-2-3-7-13-12/h2-4,7,11H,5-6,8-9H2,1H3.
What are the key properties of 1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone?
1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone has a molecular weight of 220.27 g/mol, XLogP of 1.47, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone is sourced from PubChem (CID 71798593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).