6,6,8-trimethyl-1-azaspiro[3.5]nonan-2-one

C11H19NO — CID 64664078

IUPAC6,6,8-trimethyl-1-azaspiro[3.5]nonan-2-one
SMILESCC1CC(C)(C)CC2(CC(=O)N2)C1
InChIInChI=1S/C11H19NO/c1-8-4-10(2,3)7-11(5-8)6-9(13)12-11/h8H,4-7H2,1-3H3,(H,12,13)
InChIKeyNBPICGFKERXICE-UHFFFAOYSA-N
MW181.28 g/mol
LogP2.09
Rot. Bonds

About 6,6,8-trimethyl-1-azaspiro[3.5]nonan-2-one

6,6,8-trimethyl-1-azaspiro[3.5]nonan-2-one (PubChem CID 64664078) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is 6,6,8-trimethyl-1-azaspiro[3.5]nonan-2-one.

Molecular Properties

Compound Name6,6,8-trimethyl-1-azaspiro[3.5]nonan-2-one
PubChem CID64664078
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Name6,6,8-trimethyl-1-azaspiro[3.5]nonan-2-one
SMILESCC1CC(C)(C)CC2(CC(=O)N2)C1
InChIInChI=1S/C11H19NO/c1-8-4-10(2,3)7-11(5-8)6-9(13)12-11/h8H,4-7H2,1-3H3,(H,12,13)
InChIKeyNBPICGFKERXICE-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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Related Compounds

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CID 164647039
1,1,7,7,9-pentamethyl-2-azaspiro[4.5]decan-3-one
CID 66107420
5,7,7-trimethyl-1-azaspiro[3.4]octan-2-one
CID 106664189
1,1,3-trimethylcyclobutane
CID 12656861
7-methyl-1-azaspiro[3.6]decan-2-one
CID 65082939
2-tert-butyl-7,7,9-trimethyl-1,2,4-triazaspiro[4.5]decan-3-one
CID 16763100
fluoromethane;1,3,3,5-tetramethylcyclohexan-1-ol
CID 142032504
6-propan-2-yl-1-azaspiro[3.3]heptan-2-one
CID 103565033
6,6,8-trimethyl-2-oxo-1-azaspiro[3.5]nonane-1-sulfonyl chloride
CID 64664074
2,2,4,6-tetramethyl-8-azaspiro[4.5]decane-7,9-dione
CID 106664475
6-methoxy-1-azaspiro[3.5]nonan-2-one
CID 106874445
1-ethyl-1,3,3,5-tetramethylcyclohexane;methane
CID 144643068

Frequently Asked Questions

What is the IUPAC name of 6,6,8-trimethyl-1-azaspiro[3.5]nonan-2-one?
The IUPAC name of 6,6,8-trimethyl-1-azaspiro[3.5]nonan-2-one (CID 64664078) is 6,6,8-trimethyl-1-azaspiro[3.5]nonan-2-one.
What is the SMILES notation for 6,6,8-trimethyl-1-azaspiro[3.5]nonan-2-one?
The canonical SMILES for 6,6,8-trimethyl-1-azaspiro[3.5]nonan-2-one is CC1CC(C)(C)CC2(CC(=O)N2)C1.
What is the InChIKey of 6,6,8-trimethyl-1-azaspiro[3.5]nonan-2-one?
The InChIKey is NBPICGFKERXICE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO/c1-8-4-10(2,3)7-11(5-8)6-9(13)12-11/h8H,4-7H2,1-3H3,(H,12,13).
What are the key properties of 6,6,8-trimethyl-1-azaspiro[3.5]nonan-2-one?
6,6,8-trimethyl-1-azaspiro[3.5]nonan-2-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 6,6,8-trimethyl-1-azaspiro[3.5]nonan-2-one is sourced from PubChem (CID 64664078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).