6-methyl-2,6-diazaspiro[4.5]decan-3-one

C9H16N2O — CID 105433849

IUPAC6-methyl-2,6-diazaspiro[4.5]decan-3-one
SMILESCN1CCCCC12CNC(=O)C2
InChIInChI=1S/C9H16N2O/c1-11-5-3-2-4-9(11)6-8(12)10-7-9/h2-7H2,1H3,(H,10,12)
InChIKeyINTUVDPHKLBDDG-UHFFFAOYSA-N
MW168.24 g/mol
LogP0.36
Rot. Bonds

About 6-methyl-2,6-diazaspiro[4.5]decan-3-one

6-methyl-2,6-diazaspiro[4.5]decan-3-one (PubChem CID 105433849) has the molecular formula C9H16N2O and a molecular weight of 168.24 g/mol. Its IUPAC name is 6-methyl-2,6-diazaspiro[4.5]decan-3-one.

Molecular Properties

Compound Name6-methyl-2,6-diazaspiro[4.5]decan-3-one
PubChem CID105433849
Molecular FormulaC9H16N2O
Molecular Weight168.24 g/mol
Exact Mass168.13
IUPAC Name6-methyl-2,6-diazaspiro[4.5]decan-3-one
SMILESCN1CCCCC12CNC(=O)C2
InChIInChI=1S/C9H16N2O/c1-11-5-3-2-4-9(11)6-8(12)10-7-9/h2-7H2,1H3,(H,10,12)
InChIKeyINTUVDPHKLBDDG-UHFFFAOYSA-N
XLogP0.36
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-2,6-diazaspiro[4.5]decan-3-one?
The IUPAC name of 6-methyl-2,6-diazaspiro[4.5]decan-3-one (CID 105433849) is 6-methyl-2,6-diazaspiro[4.5]decan-3-one.
What is the SMILES notation for 6-methyl-2,6-diazaspiro[4.5]decan-3-one?
The canonical SMILES for 6-methyl-2,6-diazaspiro[4.5]decan-3-one is CN1CCCCC12CNC(=O)C2.
What is the InChIKey of 6-methyl-2,6-diazaspiro[4.5]decan-3-one?
The InChIKey is INTUVDPHKLBDDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O/c1-11-5-3-2-4-9(11)6-8(12)10-7-9/h2-7H2,1H3,(H,10,12).
What are the key properties of 6-methyl-2,6-diazaspiro[4.5]decan-3-one?
6-methyl-2,6-diazaspiro[4.5]decan-3-one has a molecular weight of 168.24 g/mol, XLogP of 0.36, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2,6-diazaspiro[4.5]decan-3-one is sourced from PubChem (CID 105433849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).