2-(1-hydroxy-3-methylbutan-2-yl)-2-azaspiro[4.6]undecane-1,3-dione

C15H25NO3 — CID 79244706

IUPAC2-(1-hydroxy-3-methylbutan-2-yl)-2-azaspiro[4.6]undecane-1,3-dione
SMILESCC(C)C(CO)N1C(=O)CC2(CCCCCC2)C1=O
InChIInChI=1S/C15H25NO3/c1-11(2)12(10-17)16-13(18)9-15(14(16)19)7-5-3-4-6-8-15/h11-12,17H,3-10H2,1-2H3
InChIKeyAIOOXFGMMQVCBN-UHFFFAOYSA-N
MW267.37 g/mol
LogP2.10
Rot. Bonds3

About 2-(1-hydroxy-3-methylbutan-2-yl)-2-azaspiro[4.6]undecane-1,3-dione

2-(1-hydroxy-3-methylbutan-2-yl)-2-azaspiro[4.6]undecane-1,3-dione (PubChem CID 79244706) has the molecular formula C15H25NO3 and a molecular weight of 267.37 g/mol. Its IUPAC name is 2-(1-hydroxy-3-methylbutan-2-yl)-2-azaspiro[4.6]undecane-1,3-dione.

Molecular Properties

Compound Name2-(1-hydroxy-3-methylbutan-2-yl)-2-azaspiro[4.6]undecane-1,3-dione
PubChem CID79244706
Molecular FormulaC15H25NO3
Molecular Weight267.37 g/mol
Exact Mass267.18
IUPAC Name2-(1-hydroxy-3-methylbutan-2-yl)-2-azaspiro[4.6]undecane-1,3-dione
SMILESCC(C)C(CO)N1C(=O)CC2(CCCCCC2)C1=O
InChIInChI=1S/C15H25NO3/c1-11(2)12(10-17)16-13(18)9-15(14(16)19)7-5-3-4-6-8-15/h11-12,17H,3-10H2,1-2H3
InChIKeyAIOOXFGMMQVCBN-UHFFFAOYSA-N
XLogP2.10
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

2-[(2R)-1-hydroxypropan-2-yl]-2-azaspiro[4.6]undecane-1,3-dione
CID 79028131
2-(4-aminobutan-2-yl)-2-azaspiro[4.6]undecane-1,3-dione
CID 62092760
2-(1,3-dioxo-2-azaspiro[4.6]undecan-2-yl)propanenitrile
CID 54904488
2-(4-hydroxy-1-methoxybutan-2-yl)-2-azaspiro[4.6]undecane-1,3-dione
CID 106159175
2-(1,3-dioxo-2-azaspiro[4.6]undecan-2-yl)hexanoic acid
CID 43470102
2-(1,3-dioxo-2-azaspiro[4.6]undecan-2-yl)butanenitrile
CID 61122730
2-(1-piperidin-4-ylethyl)-2-azaspiro[4.5]decane-1,3-dione
CID 43523550
3-(1,3-dioxo-2-azaspiro[4.6]undecan-2-yl)pentanenitrile
CID 62646183
2-hydroxy-2-azaspiro[4.11]hexadecane-1,3-dione
CID 10563768
2-[1-(1H-1,2,4-triazol-5-yl)ethyl]-2-azaspiro[4.4]nonane-1,3-dione
CID 106282470
2-(2-amino-3-hydroxybutyl)-2-azaspiro[4.5]decane-1,3-dione
CID 64539399
2-(2-hydroxy-4-methylpentyl)-2-azaspiro[4.6]undecane-1,3-dione
CID 107155565

Frequently Asked Questions

What is the IUPAC name of 2-(1-hydroxy-3-methylbutan-2-yl)-2-azaspiro[4.6]undecane-1,3-dione?
The IUPAC name of 2-(1-hydroxy-3-methylbutan-2-yl)-2-azaspiro[4.6]undecane-1,3-dione (CID 79244706) is 2-(1-hydroxy-3-methylbutan-2-yl)-2-azaspiro[4.6]undecane-1,3-dione.
What is the SMILES notation for 2-(1-hydroxy-3-methylbutan-2-yl)-2-azaspiro[4.6]undecane-1,3-dione?
The canonical SMILES for 2-(1-hydroxy-3-methylbutan-2-yl)-2-azaspiro[4.6]undecane-1,3-dione is CC(C)C(CO)N1C(=O)CC2(CCCCCC2)C1=O.
What is the InChIKey of 2-(1-hydroxy-3-methylbutan-2-yl)-2-azaspiro[4.6]undecane-1,3-dione?
The InChIKey is AIOOXFGMMQVCBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO3/c1-11(2)12(10-17)16-13(18)9-15(14(16)19)7-5-3-4-6-8-15/h11-12,17H,3-10H2,1-2H3.
What are the key properties of 2-(1-hydroxy-3-methylbutan-2-yl)-2-azaspiro[4.6]undecane-1,3-dione?
2-(1-hydroxy-3-methylbutan-2-yl)-2-azaspiro[4.6]undecane-1,3-dione has a molecular weight of 267.37 g/mol, XLogP of 2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hydroxy-3-methylbutan-2-yl)-2-azaspiro[4.6]undecane-1,3-dione is sourced from PubChem (CID 79244706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).