(6-methyl-5-oxa-8-azaspiro[3.5]nonan-8-yl)-([1,2,4]triazolo[4,3-a]pyridin-5-yl)methanone

C15H18N4O2 — CID 166278464

IUPAC(6-methyl-5-oxa-8-azaspiro[3.5]nonan-8-yl)-([1,2,4]triazolo[4,3-a]pyridin-5-yl)methanone
SMILESCC1CN(C(=O)c2cccc3nncn23)CC2(CCC2)O1
InChIInChI=1S/C15H18N4O2/c1-11-8-18(9-15(21-11)6-3-7-15)14(20)12-4-2-5-13-17-16-10-19(12)13/h2,4-5,10-11H,3,6-9H2,1H3
InChIKeyWTVPRDGBHYXPJT-UHFFFAOYSA-N
MW286.33 g/mol
LogP1.51
Rot. Bonds1

About (6-methyl-5-oxa-8-azaspiro[3.5]nonan-8-yl)-([1,2,4]triazolo[4,3-a]pyridin-5-yl)methanone

(6-methyl-5-oxa-8-azaspiro[3.5]nonan-8-yl)-([1,2,4]triazolo[4,3-a]pyridin-5-yl)methanone (PubChem CID 166278464) has the molecular formula C15H18N4O2 and a molecular weight of 286.33 g/mol. Its IUPAC name is (6-methyl-5-oxa-8-azaspiro[3.5]nonan-8-yl)-([1,2,4]triazolo[4,3-a]pyridin-5-yl)methanone.

Molecular Properties

Compound Name(6-methyl-5-oxa-8-azaspiro[3.5]nonan-8-yl)-([1,2,4]triazolo[4,3-a]pyridin-5-yl)methanone
PubChem CID166278464
Molecular FormulaC15H18N4O2
Molecular Weight286.33 g/mol
Exact Mass286.14
IUPAC Name(6-methyl-5-oxa-8-azaspiro[3.5]nonan-8-yl)-([1,2,4]triazolo[4,3-a]pyridin-5-yl)methanone
SMILESCC1CN(C(=O)c2cccc3nncn23)CC2(CCC2)O1
InChIInChI=1S/C15H18N4O2/c1-11-8-18(9-15(21-11)6-3-7-15)14(20)12-4-2-5-13-17-16-10-19(12)13/h2,4-5,10-11H,3,6-9H2,1H3
InChIKeyWTVPRDGBHYXPJT-UHFFFAOYSA-N
XLogP1.51
TPSA59.73 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

[(2S)-2-methylmorpholin-4-yl]-([1,2,4]triazolo[4,3-a]pyridin-5-yl)methanone
CID 166278364
(3-methoxy-1-benzofuran-2-yl)-(6-methyl-5-oxa-8-azaspiro[3.5]nonan-8-yl)methanone
CID 138002387
[3-(furan-2-yl)-2-azaspiro[3.4]octan-2-yl]-([1,2,4]triazolo[4,3-a]pyridin-5-yl)methanone
CID 154854868
1-[5-([1,2,4]triazolo[4,3-a]pyridine-5-carbonyl)-3,4-dihydro-2H-1,5-benzodiazepin-1-yl]ethanone
CID 167934152
6-methyl-N-(3-methyl-4-pyridinyl)-5-oxa-8-azaspiro[3.5]nonane-8-carboxamide
CID 128918682
1-[1-methyl-5-[(2S,6R)-2-methyl-1,8-dioxa-4-azaspiro[5.5]undecane-4-carbonyl]pyrrol-3-yl]ethanone
CID 124887037
N-[[4-(2-methyl-1-oxa-4-azaspiro[5.5]undecane-4-carbonyl)phenyl]methyl]prop-2-enamide
CID 166405890
(5S,7S)-7-methyl-N-pyridazin-3-yl-2,6-dioxa-9-azaspiro[4.5]decane-9-carboxamide
CID 124741114
[4-(4-bromo-3,5-dimethylpyrazol-1-yl)phenyl]-[(2S)-2-methyl-1,9-dioxa-4-azaspiro[5.5]undecan-4-yl]methanone
CID 171359325
[9-[2-(5-fluoro-3-pyridinyl)ethyl]-2-methyl-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl]-phenylmethanone
CID 118570230
[(5R,7S)-7-methyl-2,6-dioxa-9-azaspiro[4.5]decan-9-yl]-(1-propan-2-ylimidazol-4-yl)methanone
CID 124725248
[8-(4-ethyl-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]-(1-methylpyrrol-2-yl)methanone
CID 155880426

Frequently Asked Questions

What is the IUPAC name of (6-methyl-5-oxa-8-azaspiro[3.5]nonan-8-yl)-([1,2,4]triazolo[4,3-a]pyridin-5-yl)methanone?
The IUPAC name of (6-methyl-5-oxa-8-azaspiro[3.5]nonan-8-yl)-([1,2,4]triazolo[4,3-a]pyridin-5-yl)methanone (CID 166278464) is (6-methyl-5-oxa-8-azaspiro[3.5]nonan-8-yl)-([1,2,4]triazolo[4,3-a]pyridin-5-yl)methanone.
What is the SMILES notation for (6-methyl-5-oxa-8-azaspiro[3.5]nonan-8-yl)-([1,2,4]triazolo[4,3-a]pyridin-5-yl)methanone?
The canonical SMILES for (6-methyl-5-oxa-8-azaspiro[3.5]nonan-8-yl)-([1,2,4]triazolo[4,3-a]pyridin-5-yl)methanone is CC1CN(C(=O)c2cccc3nncn23)CC2(CCC2)O1.
What is the InChIKey of (6-methyl-5-oxa-8-azaspiro[3.5]nonan-8-yl)-([1,2,4]triazolo[4,3-a]pyridin-5-yl)methanone?
The InChIKey is WTVPRDGBHYXPJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-11-8-18(9-15(21-11)6-3-7-15)14(20)12-4-2-5-13-17-16-10-19(12)13/h2,4-5,10-11H,3,6-9H2,1H3.
What are the key properties of (6-methyl-5-oxa-8-azaspiro[3.5]nonan-8-yl)-([1,2,4]triazolo[4,3-a]pyridin-5-yl)methanone?
(6-methyl-5-oxa-8-azaspiro[3.5]nonan-8-yl)-([1,2,4]triazolo[4,3-a]pyridin-5-yl)methanone has a molecular weight of 286.33 g/mol, XLogP of 1.51, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methyl-5-oxa-8-azaspiro[3.5]nonan-8-yl)-([1,2,4]triazolo[4,3-a]pyridin-5-yl)methanone is sourced from PubChem (CID 166278464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).