8-methyl-7,9-diazaspiro[4.5]dec-7-en-10-one

C9H14N2O — CID 55265202

IUPAC8-methyl-7,9-diazaspiro[4.5]dec-7-en-10-one
SMILESCC1=NCC2(CCCC2)C(=O)N1
InChIInChI=1S/C9H14N2O/c1-7-10-6-9(8(12)11-7)4-2-3-5-9/h2-6H2,1H3,(H,10,11,12)
InChIKeyJCRNBTBPPGTQBC-UHFFFAOYSA-N
MW166.22 g/mol
LogP1.10
Rot. Bonds

About 8-methyl-7,9-diazaspiro[4.5]dec-7-en-10-one

8-methyl-7,9-diazaspiro[4.5]dec-7-en-10-one (PubChem CID 55265202) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is 8-methyl-7,9-diazaspiro[4.5]dec-7-en-10-one.

Molecular Properties

Compound Name8-methyl-7,9-diazaspiro[4.5]dec-7-en-10-one
PubChem CID55265202
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name8-methyl-7,9-diazaspiro[4.5]dec-7-en-10-one
SMILESCC1=NCC2(CCCC2)C(=O)N1
InChIInChI=1S/C9H14N2O/c1-7-10-6-9(8(12)11-7)4-2-3-5-9/h2-6H2,1H3,(H,10,11,12)
InChIKeyJCRNBTBPPGTQBC-UHFFFAOYSA-N
XLogP1.10
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-7,9-diazaspiro[4.5]dec-7-en-10-one?
The IUPAC name of 8-methyl-7,9-diazaspiro[4.5]dec-7-en-10-one (CID 55265202) is 8-methyl-7,9-diazaspiro[4.5]dec-7-en-10-one.
What is the SMILES notation for 8-methyl-7,9-diazaspiro[4.5]dec-7-en-10-one?
The canonical SMILES for 8-methyl-7,9-diazaspiro[4.5]dec-7-en-10-one is CC1=NCC2(CCCC2)C(=O)N1.
What is the InChIKey of 8-methyl-7,9-diazaspiro[4.5]dec-7-en-10-one?
The InChIKey is JCRNBTBPPGTQBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-7-10-6-9(8(12)11-7)4-2-3-5-9/h2-6H2,1H3,(H,10,11,12).
What are the key properties of 8-methyl-7,9-diazaspiro[4.5]dec-7-en-10-one?
8-methyl-7,9-diazaspiro[4.5]dec-7-en-10-one has a molecular weight of 166.22 g/mol, XLogP of 1.10, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-7,9-diazaspiro[4.5]dec-7-en-10-one is sourced from PubChem (CID 55265202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).