1-[3-[(1R,2R)-2-hydroxycyclopentyl]oxyazetidin-1-yl]ethanone

C10H17NO3 — CID 167716521

IUPAC1-[3-[(1R,2R)-2-hydroxycyclopentyl]oxyazetidin-1-yl]ethanone
SMILESCC(=O)N1CC(O[C@@H]2CCC[C@H]2O)C1
InChIInChI=1S/C10H17NO3/c1-7(12)11-5-8(6-11)14-10-4-2-3-9(10)13/h8-10,13H,2-6H2,1H3/t9-,10-/m1/s1
InChIKeyJFGAMBRNSVDEFS-NXEZZACHSA-N
MW199.25 g/mol
LogP0.15
Rot. Bonds2

About 1-[3-[(1R,2R)-2-hydroxycyclopentyl]oxyazetidin-1-yl]ethanone

1-[3-[(1R,2R)-2-hydroxycyclopentyl]oxyazetidin-1-yl]ethanone (PubChem CID 167716521) has the molecular formula C10H17NO3 and a molecular weight of 199.25 g/mol. Its IUPAC name is 1-[3-[(1R,2R)-2-hydroxycyclopentyl]oxyazetidin-1-yl]ethanone.

Molecular Properties

Compound Name1-[3-[(1R,2R)-2-hydroxycyclopentyl]oxyazetidin-1-yl]ethanone
PubChem CID167716521
Molecular FormulaC10H17NO3
Molecular Weight199.25 g/mol
Exact Mass199.12
IUPAC Name1-[3-[(1R,2R)-2-hydroxycyclopentyl]oxyazetidin-1-yl]ethanone
SMILESCC(=O)N1CC(O[C@@H]2CCC[C@H]2O)C1
InChIInChI=1S/C10H17NO3/c1-7(12)11-5-8(6-11)14-10-4-2-3-9(10)13/h8-10,13H,2-6H2,1H3/t9-,10-/m1/s1
InChIKeyJFGAMBRNSVDEFS-NXEZZACHSA-N
XLogP0.15
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

trans-(1R,2R)-2-cyclohexyloxycyclopentan-1-ol
CID 131704149
4-(2-hydroxycycloheptyl)oxycyclohexane-1-carboxylic acid
CID 114451121
ethane;1-[(3R)-3-hydroxy-4-methoxypyrrolidin-1-yl]ethanone
CID 143657767
1-(3,4-dimethoxypyrrolidin-1-yl)ethanone
CID 89259810
(1-acetylazetidin-3-yl) carbamate
CID 155065317
[(1R,2S)-2-hydroxycyclopentyl] pyrrolidine-1-carboxylate
CID 101426040
1-(3-methoxypyrrolidin-1-yl)ethanone
CID 19039602
1-[4-[(2-cyclopentyloxycyclohexyl)amino]piperidin-1-yl]ethanone
CID 84596160
ethane;2-methoxycyclopentan-1-ol
CID 177178786
tert-butyl 3-[(3S,4S)-4-hydroxypyrrolidin-3-yl]oxyazetidine-1-carboxylate
CID 170257271
[(1R,2S)-2-hydroxycyclopentyl] carbamate
CID 175128754
[(1R,2S)-2-hydroxycyclohexyl] pyrrolidine-1-carboxylate
CID 11424413

Frequently Asked Questions

What is the IUPAC name of 1-[3-[(1R,2R)-2-hydroxycyclopentyl]oxyazetidin-1-yl]ethanone?
The IUPAC name of 1-[3-[(1R,2R)-2-hydroxycyclopentyl]oxyazetidin-1-yl]ethanone (CID 167716521) is 1-[3-[(1R,2R)-2-hydroxycyclopentyl]oxyazetidin-1-yl]ethanone.
What is the SMILES notation for 1-[3-[(1R,2R)-2-hydroxycyclopentyl]oxyazetidin-1-yl]ethanone?
The canonical SMILES for 1-[3-[(1R,2R)-2-hydroxycyclopentyl]oxyazetidin-1-yl]ethanone is CC(=O)N1CC(O[C@@H]2CCC[C@H]2O)C1.
What is the InChIKey of 1-[3-[(1R,2R)-2-hydroxycyclopentyl]oxyazetidin-1-yl]ethanone?
The InChIKey is JFGAMBRNSVDEFS-NXEZZACHSA-N. The full InChI is InChI=1S/C10H17NO3/c1-7(12)11-5-8(6-11)14-10-4-2-3-9(10)13/h8-10,13H,2-6H2,1H3/t9-,10-/m1/s1.
What are the key properties of 1-[3-[(1R,2R)-2-hydroxycyclopentyl]oxyazetidin-1-yl]ethanone?
1-[3-[(1R,2R)-2-hydroxycyclopentyl]oxyazetidin-1-yl]ethanone has a molecular weight of 199.25 g/mol, XLogP of 0.15, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[(1R,2R)-2-hydroxycyclopentyl]oxyazetidin-1-yl]ethanone is sourced from PubChem (CID 167716521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).