8,8-dimethyl-2-azaspiro[4.5]decan-1-one

C11H19NO — CID 148701523

IUPAC8,8-dimethyl-2-azaspiro[4.5]decan-1-one
SMILESCC1(C)CCC2(CCNC2=O)CC1
InChIInChI=1S/C11H19NO/c1-10(2)3-5-11(6-4-10)7-8-12-9(11)13/h3-8H2,1-2H3,(H,12,13)
InChIKeyNVLLKZWQGBFFPX-UHFFFAOYSA-N
MW181.28 g/mol
LogP2.09
Rot. Bonds

About 8,8-dimethyl-2-azaspiro[4.5]decan-1-one

8,8-dimethyl-2-azaspiro[4.5]decan-1-one (PubChem CID 148701523) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is 8,8-dimethyl-2-azaspiro[4.5]decan-1-one.

Molecular Properties

Compound Name8,8-dimethyl-2-azaspiro[4.5]decan-1-one
PubChem CID148701523
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Name8,8-dimethyl-2-azaspiro[4.5]decan-1-one
SMILESCC1(C)CCC2(CCNC2=O)CC1
InChIInChI=1S/C11H19NO/c1-10(2)3-5-11(6-4-10)7-8-12-9(11)13/h3-8H2,1-2H3,(H,12,13)
InChIKeyNVLLKZWQGBFFPX-UHFFFAOYSA-N
XLogP2.09
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 8,8-dimethyl-2-azaspiro[4.5]decan-1-one?
The IUPAC name of 8,8-dimethyl-2-azaspiro[4.5]decan-1-one (CID 148701523) is 8,8-dimethyl-2-azaspiro[4.5]decan-1-one.
What is the SMILES notation for 8,8-dimethyl-2-azaspiro[4.5]decan-1-one?
The canonical SMILES for 8,8-dimethyl-2-azaspiro[4.5]decan-1-one is CC1(C)CCC2(CCNC2=O)CC1.
What is the InChIKey of 8,8-dimethyl-2-azaspiro[4.5]decan-1-one?
The InChIKey is NVLLKZWQGBFFPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO/c1-10(2)3-5-11(6-4-10)7-8-12-9(11)13/h3-8H2,1-2H3,(H,12,13).
What are the key properties of 8,8-dimethyl-2-azaspiro[4.5]decan-1-one?
8,8-dimethyl-2-azaspiro[4.5]decan-1-one has a molecular weight of 181.28 g/mol, XLogP of 2.09, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8,8-dimethyl-2-azaspiro[4.5]decan-1-one is sourced from PubChem (CID 148701523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).