3-[(6-methyl-2-pyridinyl)oxy]-1-oxa-8-azaspiro[4.5]decane

C14H20N2O2 — CID 102930458

IUPAC3-[(6-methyl-2-pyridinyl)oxy]-1-oxa-8-azaspiro[4.5]decane
SMILESCc1cccc(OC2COC3(CCNCC3)C2)n1
InChIInChI=1S/C14H20N2O2/c1-11-3-2-4-13(16-11)18-12-9-14(17-10-12)5-7-15-8-6-14/h2-4,12,15H,5-10H2,1H3
InChIKeyBRTFKUVUAQZHPA-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.68
Rot. Bonds2

About 3-[(6-methyl-2-pyridinyl)oxy]-1-oxa-8-azaspiro[4.5]decane

3-[(6-methyl-2-pyridinyl)oxy]-1-oxa-8-azaspiro[4.5]decane (PubChem CID 102930458) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 3-[(6-methyl-2-pyridinyl)oxy]-1-oxa-8-azaspiro[4.5]decane.

Molecular Properties

Compound Name3-[(6-methyl-2-pyridinyl)oxy]-1-oxa-8-azaspiro[4.5]decane
PubChem CID102930458
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name3-[(6-methyl-2-pyridinyl)oxy]-1-oxa-8-azaspiro[4.5]decane
SMILESCc1cccc(OC2COC3(CCNCC3)C2)n1
InChIInChI=1S/C14H20N2O2/c1-11-3-2-4-13(16-11)18-12-9-14(17-10-12)5-7-15-8-6-14/h2-4,12,15H,5-10H2,1H3
InChIKeyBRTFKUVUAQZHPA-UHFFFAOYSA-N
XLogP1.68
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)pyridine-2-carboxamide
CID 102930635
3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)oxy]-1-oxa-8-azaspiro[4.5]decane
CID 102930602
(3R,5S)-3-pyridin-2-yloxy-1-oxa-7-azaspiro[4.4]nonane
CID 97420064
3-(6-ethoxy-5-methylpyrimidin-4-yl)oxy-1-oxa-8-azaspiro[4.5]decane
CID 102930455
6-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)pyridine-3-carbonitrile
CID 102930474
2-methyl-6-[(3R)-pyrrolidin-3-yl]oxypyridine
CID 94406823
3-(6-propylpyrimidin-4-yl)oxy-1-oxa-8-azaspiro[4.5]decane
CID 102930624
(3S)-3-(4-fluorophenoxy)-1-oxa-8-azaspiro[4.5]decane
CID 124938709
2-methyl-6-[(3R)-piperidin-3-yl]oxypyridine
CID 94407048
3-[[4-(trifluoromethyl)-2-pyridinyl]oxy]-1-oxa-8-azaspiro[4.5]decane
CID 102930637
3-phthalazin-1-yloxy-1-oxa-8-azaspiro[4.5]decane
CID 102930556
(3R,5R)-3-pyridin-3-yloxy-1-oxa-7-azaspiro[4.4]nonane
CID 97486909

Frequently Asked Questions

What is the IUPAC name of 3-[(6-methyl-2-pyridinyl)oxy]-1-oxa-8-azaspiro[4.5]decane?
The IUPAC name of 3-[(6-methyl-2-pyridinyl)oxy]-1-oxa-8-azaspiro[4.5]decane (CID 102930458) is 3-[(6-methyl-2-pyridinyl)oxy]-1-oxa-8-azaspiro[4.5]decane.
What is the SMILES notation for 3-[(6-methyl-2-pyridinyl)oxy]-1-oxa-8-azaspiro[4.5]decane?
The canonical SMILES for 3-[(6-methyl-2-pyridinyl)oxy]-1-oxa-8-azaspiro[4.5]decane is Cc1cccc(OC2COC3(CCNCC3)C2)n1.
What is the InChIKey of 3-[(6-methyl-2-pyridinyl)oxy]-1-oxa-8-azaspiro[4.5]decane?
The InChIKey is BRTFKUVUAQZHPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-11-3-2-4-13(16-11)18-12-9-14(17-10-12)5-7-15-8-6-14/h2-4,12,15H,5-10H2,1H3.
What are the key properties of 3-[(6-methyl-2-pyridinyl)oxy]-1-oxa-8-azaspiro[4.5]decane?
3-[(6-methyl-2-pyridinyl)oxy]-1-oxa-8-azaspiro[4.5]decane has a molecular weight of 248.33 g/mol, XLogP of 1.68, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6-methyl-2-pyridinyl)oxy]-1-oxa-8-azaspiro[4.5]decane is sourced from PubChem (CID 102930458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).