(3R)-3-(methoxymethyl)-8-(6-methylpyridazin-3-yl)-2-oxa-8-azaspiro[4.5]decane

C15H23N3O2 — CID 97483535

IUPAC(3R)-3-(methoxymethyl)-8-(6-methylpyridazin-3-yl)-2-oxa-8-azaspiro[4.5]decane
SMILESCOC[C@H]1CC2(CCN(c3ccc(C)nn3)CC2)CO1
InChIInChI=1S/C15H23N3O2/c1-12-3-4-14(17-16-12)18-7-5-15(6-8-18)9-13(10-19-2)20-11-15/h3-4,13H,5-11H2,1-2H3/t13-/m1/s1
InChIKeyFTUDZTJIXOZGSZ-CYBMUJFWSA-N
MW277.37 g/mol
LogP1.81
Rot. Bonds3

About (3R)-3-(methoxymethyl)-8-(6-methylpyridazin-3-yl)-2-oxa-8-azaspiro[4.5]decane

(3R)-3-(methoxymethyl)-8-(6-methylpyridazin-3-yl)-2-oxa-8-azaspiro[4.5]decane (PubChem CID 97483535) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is (3R)-3-(methoxymethyl)-8-(6-methylpyridazin-3-yl)-2-oxa-8-azaspiro[4.5]decane.

Molecular Properties

Compound Name(3R)-3-(methoxymethyl)-8-(6-methylpyridazin-3-yl)-2-oxa-8-azaspiro[4.5]decane
PubChem CID97483535
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name(3R)-3-(methoxymethyl)-8-(6-methylpyridazin-3-yl)-2-oxa-8-azaspiro[4.5]decane
SMILESCOC[C@H]1CC2(CCN(c3ccc(C)nn3)CC2)CO1
InChIInChI=1S/C15H23N3O2/c1-12-3-4-14(17-16-12)18-7-5-15(6-8-18)9-13(10-19-2)20-11-15/h3-4,13H,5-11H2,1-2H3/t13-/m1/s1
InChIKeyFTUDZTJIXOZGSZ-CYBMUJFWSA-N
XLogP1.81
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(3R)-3-(methoxymethyl)-8-(3-methylphenyl)sulfonyl-2-oxa-8-azaspiro[4.5]decane
CID 97473995
(3S)-3-(methoxymethyl)-8-[(2-methoxyphenyl)methyl]-2-oxa-8-azaspiro[4.5]decane
CID 97418031
(4-fluoro-2-methylphenyl)-[(3R)-3-(methoxymethyl)-2-oxa-8-azaspiro[4.5]decan-8-yl]methanone
CID 97418059
3-(methoxymethyl)-8-(quinolin-2-ylmethyl)-2-oxa-8-azaspiro[4.5]decane
CID 131639788
(2,5-dimethylfuran-3-yl)-[(3R)-3-(methoxymethyl)-2-oxa-8-azaspiro[4.5]decan-8-yl]methanone
CID 97418005
8-(methoxymethyl)-5-methyl-2-(6-methylpyridazin-3-yl)-2,5-diazaspiro[3.5]nonane
CID 133137703
(2-fluorophenyl)-[(3S)-3-(methoxymethyl)-2-oxa-8-azaspiro[4.5]decan-8-yl]methanone
CID 97418003
2-(2,3-dihydro-1H-inden-2-yl)-1-[(3R)-3-(methoxymethyl)-2-oxa-8-azaspiro[4.5]decan-8-yl]ethanone
CID 97418076
(3S)-8-(2-fluorophenyl)sulfonyl-3-(methoxymethyl)-2-oxa-8-azaspiro[4.5]decane
CID 97418013
(3R)-8-(2-fluorophenyl)sulfonyl-3-(methoxymethyl)-2-oxa-8-azaspiro[4.5]decane
CID 97418014
(4aS,8aS)-4a-(methoxymethyl)-6-(6-methylpyridazin-3-yl)-3,4,5,7,8,8a-hexahydro-2H-pyrano[3,2-c]pyridine
CID 98810525
3-(6-methylpyridazin-3-yl)-9-(pyridin-4-ylmethyl)-3,9-diazaspiro[5.5]undecane
CID 97385532

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(methoxymethyl)-8-(6-methylpyridazin-3-yl)-2-oxa-8-azaspiro[4.5]decane?
The IUPAC name of (3R)-3-(methoxymethyl)-8-(6-methylpyridazin-3-yl)-2-oxa-8-azaspiro[4.5]decane (CID 97483535) is (3R)-3-(methoxymethyl)-8-(6-methylpyridazin-3-yl)-2-oxa-8-azaspiro[4.5]decane.
What is the SMILES notation for (3R)-3-(methoxymethyl)-8-(6-methylpyridazin-3-yl)-2-oxa-8-azaspiro[4.5]decane?
The canonical SMILES for (3R)-3-(methoxymethyl)-8-(6-methylpyridazin-3-yl)-2-oxa-8-azaspiro[4.5]decane is COC[C@H]1CC2(CCN(c3ccc(C)nn3)CC2)CO1.
What is the InChIKey of (3R)-3-(methoxymethyl)-8-(6-methylpyridazin-3-yl)-2-oxa-8-azaspiro[4.5]decane?
The InChIKey is FTUDZTJIXOZGSZ-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-12-3-4-14(17-16-12)18-7-5-15(6-8-18)9-13(10-19-2)20-11-15/h3-4,13H,5-11H2,1-2H3/t13-/m1/s1.
What are the key properties of (3R)-3-(methoxymethyl)-8-(6-methylpyridazin-3-yl)-2-oxa-8-azaspiro[4.5]decane?
(3R)-3-(methoxymethyl)-8-(6-methylpyridazin-3-yl)-2-oxa-8-azaspiro[4.5]decane has a molecular weight of 277.37 g/mol, XLogP of 1.81, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(methoxymethyl)-8-(6-methylpyridazin-3-yl)-2-oxa-8-azaspiro[4.5]decane is sourced from PubChem (CID 97483535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).