2-(4-methyl-5-oxo-2H-furan-3-yl)-2-azaspiro[4.5]decane-1,8-dione

C14H17NO4 — CID 118225239

IUPAC2-(4-methyl-5-oxo-2H-furan-3-yl)-2-azaspiro[4.5]decane-1,8-dione
SMILESCC1=C(N2CCC3(CCC(=O)CC3)C2=O)COC1=O
InChIInChI=1S/C14H17NO4/c1-9-11(8-19-12(9)17)15-7-6-14(13(15)18)4-2-10(16)3-5-14/h2-8H2,1H3
InChIKeyMOIBUSZYLWCQGA-UHFFFAOYSA-N
MW263.29 g/mol
LogP1.18
Rot. Bonds1

About 2-(4-methyl-5-oxo-2H-furan-3-yl)-2-azaspiro[4.5]decane-1,8-dione

2-(4-methyl-5-oxo-2H-furan-3-yl)-2-azaspiro[4.5]decane-1,8-dione (PubChem CID 118225239) has the molecular formula C14H17NO4 and a molecular weight of 263.29 g/mol. Its IUPAC name is 2-(4-methyl-5-oxo-2H-furan-3-yl)-2-azaspiro[4.5]decane-1,8-dione.

Molecular Properties

Compound Name2-(4-methyl-5-oxo-2H-furan-3-yl)-2-azaspiro[4.5]decane-1,8-dione
PubChem CID118225239
Molecular FormulaC14H17NO4
Molecular Weight263.29 g/mol
Exact Mass263.12
IUPAC Name2-(4-methyl-5-oxo-2H-furan-3-yl)-2-azaspiro[4.5]decane-1,8-dione
SMILESCC1=C(N2CCC3(CCC(=O)CC3)C2=O)COC1=O
InChIInChI=1S/C14H17NO4/c1-9-11(8-19-12(9)17)15-7-6-14(13(15)18)4-2-10(16)3-5-14/h2-8H2,1H3
InChIKeyMOIBUSZYLWCQGA-UHFFFAOYSA-N
XLogP1.18
TPSA63.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.29
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methyl-5-oxo-2H-furan-3-yl)-2-azaspiro[4.5]decane-1,8-dione?
The IUPAC name of 2-(4-methyl-5-oxo-2H-furan-3-yl)-2-azaspiro[4.5]decane-1,8-dione (CID 118225239) is 2-(4-methyl-5-oxo-2H-furan-3-yl)-2-azaspiro[4.5]decane-1,8-dione.
What is the SMILES notation for 2-(4-methyl-5-oxo-2H-furan-3-yl)-2-azaspiro[4.5]decane-1,8-dione?
The canonical SMILES for 2-(4-methyl-5-oxo-2H-furan-3-yl)-2-azaspiro[4.5]decane-1,8-dione is CC1=C(N2CCC3(CCC(=O)CC3)C2=O)COC1=O.
What is the InChIKey of 2-(4-methyl-5-oxo-2H-furan-3-yl)-2-azaspiro[4.5]decane-1,8-dione?
The InChIKey is MOIBUSZYLWCQGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO4/c1-9-11(8-19-12(9)17)15-7-6-14(13(15)18)4-2-10(16)3-5-14/h2-8H2,1H3.
What are the key properties of 2-(4-methyl-5-oxo-2H-furan-3-yl)-2-azaspiro[4.5]decane-1,8-dione?
2-(4-methyl-5-oxo-2H-furan-3-yl)-2-azaspiro[4.5]decane-1,8-dione has a molecular weight of 263.29 g/mol, XLogP of 1.18, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methyl-5-oxo-2H-furan-3-yl)-2-azaspiro[4.5]decane-1,8-dione is sourced from PubChem (CID 118225239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).