3-cyclopentyl-1-(3-pyridin-2-yloxyazetidin-1-yl)propan-1-one

C16H22N2O2 — CID 122247079

IUPAC3-cyclopentyl-1-(3-pyridin-2-yloxyazetidin-1-yl)propan-1-one
SMILESO=C(CCC1CCCC1)N1CC(Oc2ccccn2)C1
InChIInChI=1S/C16H22N2O2/c19-16(9-8-13-5-1-2-6-13)18-11-14(12-18)20-15-7-3-4-10-17-15/h3-4,7,10,13-14H,1-2,5-6,8-9,11-12H2
InChIKeyRYQIOWMNGZRFHX-UHFFFAOYSA-N
MW274.36 g/mol
LogP2.64
Rot. Bonds5

About 3-cyclopentyl-1-(3-pyridin-2-yloxyazetidin-1-yl)propan-1-one

3-cyclopentyl-1-(3-pyridin-2-yloxyazetidin-1-yl)propan-1-one (PubChem CID 122247079) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is 3-cyclopentyl-1-(3-pyridin-2-yloxyazetidin-1-yl)propan-1-one.

Molecular Properties

Compound Name3-cyclopentyl-1-(3-pyridin-2-yloxyazetidin-1-yl)propan-1-one
PubChem CID122247079
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Name3-cyclopentyl-1-(3-pyridin-2-yloxyazetidin-1-yl)propan-1-one
SMILESO=C(CCC1CCCC1)N1CC(Oc2ccccn2)C1
InChIInChI=1S/C16H22N2O2/c19-16(9-8-13-5-1-2-6-13)18-11-14(12-18)20-15-7-3-4-10-17-15/h3-4,7,10,13-14H,1-2,5-6,8-9,11-12H2
InChIKeyRYQIOWMNGZRFHX-UHFFFAOYSA-N
XLogP2.64
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-cyclohexyl-1-[3-[(6-methyl-2-pyridinyl)oxy]azetidin-1-yl]propan-1-one
CID 122249467
3-cyclopentyl-1-[(3R)-3-pyridazin-3-yloxypyrrolidin-1-yl]propan-1-one
CID 100620918
3-cyclohexyl-1-[3-(1,3-thiazol-2-yloxy)azetidin-1-yl]propan-1-one
CID 90627445
2-(4-fluorophenyl)-1-(3-pyridin-2-yloxyazetidin-1-yl)ethanone
CID 122247174
1-(3-pyridin-2-yloxyazetidin-1-yl)-2-thiophen-2-ylethanone
CID 122247181
2-(2-methylphenoxy)-1-(3-pyridin-2-yloxyazetidin-1-yl)ethanone
CID 122247163
3,3,3-trifluoro-1-[(3R)-3-pyridin-2-yloxypyrrolidin-1-yl]propan-1-one
CID 129417057
3-cyclopentyl-1-[3-(6-methoxypyridazin-3-yl)oxypyrrolidin-1-yl]propan-1-one
CID 90639054
(2-chlorophenyl)-(3-pyridin-2-yloxyazetidin-1-yl)methanone
CID 122247119
tert-butyl (3R)-3-pyridin-2-yloxypiperidine-1-carboxylate
CID 71630688
3-cyclohexyl-1-(3-pyridin-4-yloxypiperidin-1-yl)propan-1-one
CID 122255705
2-(1-tert-butylazetidin-3-yl)oxypyridine
CID 126954855

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-1-(3-pyridin-2-yloxyazetidin-1-yl)propan-1-one?
The IUPAC name of 3-cyclopentyl-1-(3-pyridin-2-yloxyazetidin-1-yl)propan-1-one (CID 122247079) is 3-cyclopentyl-1-(3-pyridin-2-yloxyazetidin-1-yl)propan-1-one.
What is the SMILES notation for 3-cyclopentyl-1-(3-pyridin-2-yloxyazetidin-1-yl)propan-1-one?
The canonical SMILES for 3-cyclopentyl-1-(3-pyridin-2-yloxyazetidin-1-yl)propan-1-one is O=C(CCC1CCCC1)N1CC(Oc2ccccn2)C1.
What is the InChIKey of 3-cyclopentyl-1-(3-pyridin-2-yloxyazetidin-1-yl)propan-1-one?
The InChIKey is RYQIOWMNGZRFHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c19-16(9-8-13-5-1-2-6-13)18-11-14(12-18)20-15-7-3-4-10-17-15/h3-4,7,10,13-14H,1-2,5-6,8-9,11-12H2.
What are the key properties of 3-cyclopentyl-1-(3-pyridin-2-yloxyazetidin-1-yl)propan-1-one?
3-cyclopentyl-1-(3-pyridin-2-yloxyazetidin-1-yl)propan-1-one has a molecular weight of 274.36 g/mol, XLogP of 2.64, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-1-(3-pyridin-2-yloxyazetidin-1-yl)propan-1-one is sourced from PubChem (CID 122247079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).