3-azaspiro[5.5]undecan-3-yl(furan-2-yl)methanone

C15H21NO2 — CID 62867411

IUPAC3-azaspiro[5.5]undecan-3-yl(furan-2-yl)methanone
SMILESO=C(c1ccco1)N1CCC2(CCCCC2)CC1
InChIInChI=1S/C15H21NO2/c17-14(13-5-4-12-18-13)16-10-8-15(9-11-16)6-2-1-3-7-15/h4-5,12H,1-3,6-11H2
InChIKeyRHJKABKPXAHYJJ-UHFFFAOYSA-N
MW247.34 g/mol
LogP3.47
Rot. Bonds1

About 3-azaspiro[5.5]undecan-3-yl(furan-2-yl)methanone

3-azaspiro[5.5]undecan-3-yl(furan-2-yl)methanone (PubChem CID 62867411) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is 3-azaspiro[5.5]undecan-3-yl(furan-2-yl)methanone.

Molecular Properties

Compound Name3-azaspiro[5.5]undecan-3-yl(furan-2-yl)methanone
PubChem CID62867411
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC Name3-azaspiro[5.5]undecan-3-yl(furan-2-yl)methanone
SMILESO=C(c1ccco1)N1CCC2(CCCCC2)CC1
InChIInChI=1S/C15H21NO2/c17-14(13-5-4-12-18-13)16-10-8-15(9-11-16)6-2-1-3-7-15/h4-5,12H,1-3,6-11H2
InChIKeyRHJKABKPXAHYJJ-UHFFFAOYSA-N
XLogP3.47
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

azepan-1-yl(furan-2-yl)methanone
CID 5200992
furan-2-yl-[4-(1-hydroxycyclopentanecarbonyl)piperazin-1-yl]methanone
CID 110906971
1,4-dioxa-8-azaspiro[4.5]decan-8-yl(furan-2-yl)methanone
CID 2225250
furan-2-yl-[4-(1-pyrrol-1-ylcyclohexanecarbonyl)piperazin-1-yl]methanone
CID 46328246
2-azaspiro[4.5]decan-2-yl-[(2S)-1-(furan-2-carbonyl)pyrrolidin-2-yl]methanone
CID 71929615
4-[[3-(furan-2-carbonyl)-3,9-diazaspiro[5.5]undecan-9-yl]methyl]benzonitrile
CID 3233444
furan-2-yl-[2-(4-phenylphenyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanone
CID 3232660
9-(furan-2-carbonyl)-N-(4-methoxyphenyl)-3,9-diazaspiro[5.5]undecane-3-carboxamide
CID 3234137
(4-cyclopropylidenepiperidin-1-yl)-(furan-2-yl)methanone
CID 121184150
furan-2-yl(thiomorpholin-4-yl)methanone
CID 2804982
furan-2-yl-[2-(pyridin-4-ylmethyl)-2,7-diazaspiro[3.5]nonan-7-yl]methanone
CID 3234982
furan-2-yl-(2-pyridin-2-yl-2,7-diazaspiro[3.5]nonan-7-yl)methanone
CID 3233080

Frequently Asked Questions

What is the IUPAC name of 3-azaspiro[5.5]undecan-3-yl(furan-2-yl)methanone?
The IUPAC name of 3-azaspiro[5.5]undecan-3-yl(furan-2-yl)methanone (CID 62867411) is 3-azaspiro[5.5]undecan-3-yl(furan-2-yl)methanone.
What is the SMILES notation for 3-azaspiro[5.5]undecan-3-yl(furan-2-yl)methanone?
The canonical SMILES for 3-azaspiro[5.5]undecan-3-yl(furan-2-yl)methanone is O=C(c1ccco1)N1CCC2(CCCCC2)CC1.
What is the InChIKey of 3-azaspiro[5.5]undecan-3-yl(furan-2-yl)methanone?
The InChIKey is RHJKABKPXAHYJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c17-14(13-5-4-12-18-13)16-10-8-15(9-11-16)6-2-1-3-7-15/h4-5,12H,1-3,6-11H2.
What are the key properties of 3-azaspiro[5.5]undecan-3-yl(furan-2-yl)methanone?
3-azaspiro[5.5]undecan-3-yl(furan-2-yl)methanone has a molecular weight of 247.34 g/mol, XLogP of 3.47, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-azaspiro[5.5]undecan-3-yl(furan-2-yl)methanone is sourced from PubChem (CID 62867411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).