1-(3-pyridin-3-yloxypyrrolidin-1-yl)ethanone

C11H14N2O2 — CID 59581393

IUPAC1-(3-pyridin-3-yloxypyrrolidin-1-yl)ethanone
SMILESCC(=O)N1CCC(Oc2cccnc2)C1
InChIInChI=1S/C11H14N2O2/c1-9(14)13-6-4-11(8-13)15-10-3-2-5-12-7-10/h2-3,5,7,11H,4,6,8H2,1H3
InChIKeyKUPDWGYKCRAMNW-UHFFFAOYSA-N
MW206.25 g/mol
LogP1.08
Rot. Bonds2

About 1-(3-pyridin-3-yloxypyrrolidin-1-yl)ethanone

1-(3-pyridin-3-yloxypyrrolidin-1-yl)ethanone (PubChem CID 59581393) has the molecular formula C11H14N2O2 and a molecular weight of 206.25 g/mol. Its IUPAC name is 1-(3-pyridin-3-yloxypyrrolidin-1-yl)ethanone.

Molecular Properties

Compound Name1-(3-pyridin-3-yloxypyrrolidin-1-yl)ethanone
PubChem CID59581393
Molecular FormulaC11H14N2O2
Molecular Weight206.25 g/mol
Exact Mass206.11
IUPAC Name1-(3-pyridin-3-yloxypyrrolidin-1-yl)ethanone
SMILESCC(=O)N1CCC(Oc2cccnc2)C1
InChIInChI=1S/C11H14N2O2/c1-9(14)13-6-4-11(8-13)15-10-3-2-5-12-7-10/h2-3,5,7,11H,4,6,8H2,1H3
InChIKeyKUPDWGYKCRAMNW-UHFFFAOYSA-N
XLogP1.08
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-oxo-2-(3-pyridin-3-yloxypyrrolidin-1-yl)acetamide
CID 175996540
pyridin-4-yl-(3-pyridin-3-yloxypyrrolidin-1-yl)methanone
CID 110876433
(2R)-2-amino-1-[(3R)-3-pyridin-3-yloxypyrrolidin-1-yl]propan-1-one
CID 124593054
(3S)-N-pyridin-2-yl-3-pyridin-3-yloxypyrrolidine-1-carboxamide
CID 97084803
1-[4-(3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octane-8-carbonyl)piperidin-1-yl]ethanone
CID 121186032
(2S)-2-amino-2-phenyl-1-[(3R)-3-pyridin-3-yloxypyrrolidin-1-yl]ethanone
CID 99852524
3-(1-methylpiperidin-4-yl)oxypyridine
CID 18433351
1-(3-pyridazin-3-yloxypyrrolidin-1-yl)ethanone
CID 90638196
2-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[(3S)-3-pyridin-3-yloxypyrrolidin-1-yl]ethanone
CID 129382162
(3S)-N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-pyridin-3-yloxypyrrolidine-1-carboxamide
CID 97078503
2-(3-pyridin-3-yloxypyrrolidin-1-yl)acetamide
CID 175996519
[1-(4-fluorophenyl)-5-methylpyrazol-3-yl]-(3-pyridin-3-yloxypyrrolidin-1-yl)methanone
CID 126792647

Frequently Asked Questions

What is the IUPAC name of 1-(3-pyridin-3-yloxypyrrolidin-1-yl)ethanone?
The IUPAC name of 1-(3-pyridin-3-yloxypyrrolidin-1-yl)ethanone (CID 59581393) is 1-(3-pyridin-3-yloxypyrrolidin-1-yl)ethanone.
What is the SMILES notation for 1-(3-pyridin-3-yloxypyrrolidin-1-yl)ethanone?
The canonical SMILES for 1-(3-pyridin-3-yloxypyrrolidin-1-yl)ethanone is CC(=O)N1CCC(Oc2cccnc2)C1.
What is the InChIKey of 1-(3-pyridin-3-yloxypyrrolidin-1-yl)ethanone?
The InChIKey is KUPDWGYKCRAMNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-9(14)13-6-4-11(8-13)15-10-3-2-5-12-7-10/h2-3,5,7,11H,4,6,8H2,1H3.
What are the key properties of 1-(3-pyridin-3-yloxypyrrolidin-1-yl)ethanone?
1-(3-pyridin-3-yloxypyrrolidin-1-yl)ethanone has a molecular weight of 206.25 g/mol, XLogP of 1.08, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-pyridin-3-yloxypyrrolidin-1-yl)ethanone is sourced from PubChem (CID 59581393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).