5-(oxetan-3-yl)-2,5-diazaspiro[3.4]octane

C9H16N2O — CID 166543486

IUPAC5-(oxetan-3-yl)-2,5-diazaspiro[3.4]octane
SMILESC1CN(C2COC2)C2(C1)CNC2
InChIInChI=1S/C9H16N2O/c1-2-9(6-10-7-9)11(3-1)8-4-12-5-8/h8,10H,1-7H2
InChIKeyAPLUGIKKIQBHPF-UHFFFAOYSA-N
MW168.24 g/mol
LogP-0.18
Rot. Bonds1

About 5-(oxetan-3-yl)-2,5-diazaspiro[3.4]octane

5-(oxetan-3-yl)-2,5-diazaspiro[3.4]octane (PubChem CID 166543486) has the molecular formula C9H16N2O and a molecular weight of 168.24 g/mol. Its IUPAC name is 5-(oxetan-3-yl)-2,5-diazaspiro[3.4]octane.

Molecular Properties

Compound Name5-(oxetan-3-yl)-2,5-diazaspiro[3.4]octane
PubChem CID166543486
Molecular FormulaC9H16N2O
Molecular Weight168.24 g/mol
Exact Mass168.13
IUPAC Name5-(oxetan-3-yl)-2,5-diazaspiro[3.4]octane
SMILESC1CN(C2COC2)C2(C1)CNC2
InChIInChI=1S/C9H16N2O/c1-2-9(6-10-7-9)11(3-1)8-4-12-5-8/h8,10H,1-7H2
InChIKeyAPLUGIKKIQBHPF-UHFFFAOYSA-N
XLogP-0.18
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 5-0.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2-Methoxyethyl)-2,5-diazaspiro[3.4]octane dihydrochloride
CID 155822341
5-(2-Methoxyethyl)-2,5-diazaspiro[3.4]octane
CID 155822342
N,5,5-trimethyl-N-(oxetan-3-yl)pyrrolidin-3-amine
CID 162361673
2-Ethyl-5-(oxetan-3-yl)-2,5-diazaspiro[3.4]octane
CID 166542601
N-(2-methoxyethyl)-1,5,5-trimethylpyrrolidin-3-amine
CID 166869641
(3R)-1-ethyl-N-(2-methoxyethyl)-5,5-dimethylpyrrolidin-3-amine
CID 166870119
[5-(Oxetan-3-yl)-2,5-diazaspiro[3.4]octan-2-yl]methanamine
CID 167264952
7-Tert-butyl-1-(oxetan-3-yl)-1,7-diazaspiro[3.4]octane
CID 168122296
2-Tert-butyl-5-(2-methoxyethyl)-2,5-diazaspiro[3.4]octane
CID 168122307
2-Tert-butyl-5-(oxetan-3-yl)-2,5-diazaspiro[3.4]octane
CID 168122465
1-tert-butyl-N-(2-methoxyethyl)-5,5-dimethylpyrrolidin-3-amine
CID 168820370
(3S)-1-tert-butyl-N-(2-methoxyethyl)-5,5-dimethylpyrrolidin-3-amine
CID 168820566

Frequently Asked Questions

What is the IUPAC name of 5-(oxetan-3-yl)-2,5-diazaspiro[3.4]octane?
The IUPAC name of 5-(oxetan-3-yl)-2,5-diazaspiro[3.4]octane (CID 166543486) is 5-(oxetan-3-yl)-2,5-diazaspiro[3.4]octane.
What is the SMILES notation for 5-(oxetan-3-yl)-2,5-diazaspiro[3.4]octane?
The canonical SMILES for 5-(oxetan-3-yl)-2,5-diazaspiro[3.4]octane is C1CN(C2COC2)C2(C1)CNC2.
What is the InChIKey of 5-(oxetan-3-yl)-2,5-diazaspiro[3.4]octane?
The InChIKey is APLUGIKKIQBHPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O/c1-2-9(6-10-7-9)11(3-1)8-4-12-5-8/h8,10H,1-7H2.
What are the key properties of 5-(oxetan-3-yl)-2,5-diazaspiro[3.4]octane?
5-(oxetan-3-yl)-2,5-diazaspiro[3.4]octane has a molecular weight of 168.24 g/mol, XLogP of -0.18, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(oxetan-3-yl)-2,5-diazaspiro[3.4]octane is sourced from PubChem (CID 166543486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).