3-[2-(oxolan-3-yloxy)ethyl]azetidine

C9H17NO2 — CID 107391728

IUPAC3-[2-(oxolan-3-yloxy)ethyl]azetidine
SMILESC1CC(OCCC2CNC2)CO1
InChIInChI=1S/C9H17NO2/c1(8-5-10-6-8)4-12-9-2-3-11-7-9/h8-10H,1-7H2
InChIKeyIOAJLPQAICWEGZ-UHFFFAOYSA-N
MW171.24 g/mol
LogP0.40
Rot. Bonds4

About 3-[2-(oxolan-3-yloxy)ethyl]azetidine

3-[2-(oxolan-3-yloxy)ethyl]azetidine (PubChem CID 107391728) has the molecular formula C9H17NO2 and a molecular weight of 171.24 g/mol. Its IUPAC name is 3-[2-(oxolan-3-yloxy)ethyl]azetidine.

Molecular Properties

Compound Name3-[2-(oxolan-3-yloxy)ethyl]azetidine
PubChem CID107391728
Molecular FormulaC9H17NO2
Molecular Weight171.24 g/mol
Exact Mass171.13
IUPAC Name3-[2-(oxolan-3-yloxy)ethyl]azetidine
SMILESC1CC(OCCC2CNC2)CO1
InChIInChI=1S/C9H17NO2/c1(8-5-10-6-8)4-12-9-2-3-11-7-9/h8-10H,1-7H2
InChIKeyIOAJLPQAICWEGZ-UHFFFAOYSA-N
XLogP0.40
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-tert-butyl-4-[2-(oxolan-3-yloxy)ethyl]piperidine
CID 155138836
3-propoxyoxolane
CID 14071397
3-[(3R)-oxolan-3-yl]oxypropan-1-amine
CID 95969618
(3R)-3-(3-bromopropoxy)oxolane
CID 95240996
3-[2-(oxan-4-yl)ethyl]azetidine;hydrochloride
CID 126845734
2-(oxolan-3-yloxy)acetaldehyde
CID 54518073
2-[2-(oxolan-3-yloxy)ethoxy]ethanamine
CID 103482534
ethane;3-ethoxyoxolane
CID 142523367
4-(oxolan-3-yloxy)butan-2-one
CID 63559452
3-[2-(5-oxaspiro[3.5]nonan-8-yloxy)ethyl]piperidine
CID 79894785
N-[3-(oxolan-3-yloxy)propyl]piperidine-3-carboxamide
CID 119340232
3-[2-(2-bromocyclopentyl)oxyethoxy]oxolane
CID 165492983

Frequently Asked Questions

What is the IUPAC name of 3-[2-(oxolan-3-yloxy)ethyl]azetidine?
The IUPAC name of 3-[2-(oxolan-3-yloxy)ethyl]azetidine (CID 107391728) is 3-[2-(oxolan-3-yloxy)ethyl]azetidine.
What is the SMILES notation for 3-[2-(oxolan-3-yloxy)ethyl]azetidine?
The canonical SMILES for 3-[2-(oxolan-3-yloxy)ethyl]azetidine is C1CC(OCCC2CNC2)CO1.
What is the InChIKey of 3-[2-(oxolan-3-yloxy)ethyl]azetidine?
The InChIKey is IOAJLPQAICWEGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO2/c1(8-5-10-6-8)4-12-9-2-3-11-7-9/h8-10H,1-7H2.
What are the key properties of 3-[2-(oxolan-3-yloxy)ethyl]azetidine?
3-[2-(oxolan-3-yloxy)ethyl]azetidine has a molecular weight of 171.24 g/mol, XLogP of 0.40, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(oxolan-3-yloxy)ethyl]azetidine is sourced from PubChem (CID 107391728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).