5-oxa-8-azaspiro[2.6]nonan-8-yl(spiro[2.4]heptan-2-yl)methanone

C15H23NO2 — CID 127807974

IUPAC5-oxa-8-azaspiro[2.6]nonan-8-yl(spiro[2.4]heptan-2-yl)methanone
SMILESO=C(C1CC12CCCC2)N1CCOCC2(CC2)C1
InChIInChI=1S/C15H23NO2/c17-13(12-9-15(12)3-1-2-4-15)16-7-8-18-11-14(10-16)5-6-14/h12H,1-11H2
InChIKeyMDXBRVALTJMABS-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.21
Rot. Bonds1

About 5-oxa-8-azaspiro[2.6]nonan-8-yl(spiro[2.4]heptan-2-yl)methanone

5-oxa-8-azaspiro[2.6]nonan-8-yl(spiro[2.4]heptan-2-yl)methanone (PubChem CID 127807974) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 5-oxa-8-azaspiro[2.6]nonan-8-yl(spiro[2.4]heptan-2-yl)methanone.

Molecular Properties

Compound Name5-oxa-8-azaspiro[2.6]nonan-8-yl(spiro[2.4]heptan-2-yl)methanone
PubChem CID127807974
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name5-oxa-8-azaspiro[2.6]nonan-8-yl(spiro[2.4]heptan-2-yl)methanone
SMILESO=C(C1CC12CCCC2)N1CCOCC2(CC2)C1
InChIInChI=1S/C15H23NO2/c17-13(12-9-15(12)3-1-2-4-15)16-7-8-18-11-14(10-16)5-6-14/h12H,1-11H2
InChIKeyMDXBRVALTJMABS-UHFFFAOYSA-N
XLogP2.21
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-oxa-4-azaspiro[5.6]dodecan-4-yl(5-oxaspiro[2.4]heptan-2-yl)methanone
CID 127875131
6-(spiro[2.4]heptane-2-carbonyl)-6-azaspiro[2.5]octane-2-carboxylic acid
CID 119175025
5-azaspiro[2.4]heptan-2-yl(1,4-oxazepan-4-yl)methanone
CID 138039435
[2-(2-oxa-8-azaspiro[3.5]nonane-8-carbonyl)cyclobutyl]-(2-oxa-8-azaspiro[3.5]nonan-8-yl)methanone
CID 155955717
2-oxa-7-azaspiro[4.4]nonan-7-yl(piperidin-3-yl)methanone
CID 119340778
N-(2-methylcyclopentyl)-3,8-dioxa-11-azaspiro[5.6]dodecane-11-carboxamide
CID 127830794
morpholin-4-yl-[(2S)-6-(1,3,4-thiadiazol-2-yl)-6-azaspiro[2.5]octan-2-yl]methanone
CID 97493487
[(3R,4S)-4-[(3-methylimidazol-4-yl)methylamino]-1,1-dioxothiolan-3-yl]-(6-oxa-9-azaspiro[3.6]decan-9-yl)methanone
CID 166433103
[7-(4-amino-6-ethyl-1,3,5-triazin-2-yl)-2,7-diazaspiro[4.4]nonan-2-yl]-spiro[2.3]hexan-2-ylmethanone
CID 154855574
6-azaspiro[2.5]octan-2-yl-(1,1-dioxo-1,4-thiazepan-4-yl)methanone
CID 103872611
[(5R,9R)-2-methylsulfonyl-2-azaspiro[4.4]nonan-9-yl]-morpholin-4-ylmethanone
CID 98896559
[(2R,3S)-5-azaspiro[2.4]heptan-2-yl]-pyrrolidin-1-ylmethanone
CID 97492765

Frequently Asked Questions

What is the IUPAC name of 5-oxa-8-azaspiro[2.6]nonan-8-yl(spiro[2.4]heptan-2-yl)methanone?
The IUPAC name of 5-oxa-8-azaspiro[2.6]nonan-8-yl(spiro[2.4]heptan-2-yl)methanone (CID 127807974) is 5-oxa-8-azaspiro[2.6]nonan-8-yl(spiro[2.4]heptan-2-yl)methanone.
What is the SMILES notation for 5-oxa-8-azaspiro[2.6]nonan-8-yl(spiro[2.4]heptan-2-yl)methanone?
The canonical SMILES for 5-oxa-8-azaspiro[2.6]nonan-8-yl(spiro[2.4]heptan-2-yl)methanone is O=C(C1CC12CCCC2)N1CCOCC2(CC2)C1.
What is the InChIKey of 5-oxa-8-azaspiro[2.6]nonan-8-yl(spiro[2.4]heptan-2-yl)methanone?
The InChIKey is MDXBRVALTJMABS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c17-13(12-9-15(12)3-1-2-4-15)16-7-8-18-11-14(10-16)5-6-14/h12H,1-11H2.
What are the key properties of 5-oxa-8-azaspiro[2.6]nonan-8-yl(spiro[2.4]heptan-2-yl)methanone?
5-oxa-8-azaspiro[2.6]nonan-8-yl(spiro[2.4]heptan-2-yl)methanone has a molecular weight of 249.35 g/mol, XLogP of 2.21, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxa-8-azaspiro[2.6]nonan-8-yl(spiro[2.4]heptan-2-yl)methanone is sourced from PubChem (CID 127807974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).