8-methyl-1,8-diazaspiro[3.5]nonan-2-one

C8H14N2O — CID 169184407

IUPAC8-methyl-1,8-diazaspiro[3.5]nonan-2-one
SMILESCN1CCCC2(CC(=O)N2)C1
InChIInChI=1S/C8H14N2O/c1-10-4-2-3-8(6-10)5-7(11)9-8/h2-6H2,1H3,(H,9,11)
InChIKeyLLULRZNJUHYTEE-UHFFFAOYSA-N
MW154.21 g/mol
LogP-0.03
Rot. Bonds

About 8-methyl-1,8-diazaspiro[3.5]nonan-2-one

8-methyl-1,8-diazaspiro[3.5]nonan-2-one (PubChem CID 169184407) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is 8-methyl-1,8-diazaspiro[3.5]nonan-2-one.

Molecular Properties

Compound Name8-methyl-1,8-diazaspiro[3.5]nonan-2-one
PubChem CID169184407
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name8-methyl-1,8-diazaspiro[3.5]nonan-2-one
SMILESCN1CCCC2(CC(=O)N2)C1
InChIInChI=1S/C8H14N2O/c1-10-4-2-3-8(6-10)5-7(11)9-8/h2-6H2,1H3,(H,9,11)
InChIKeyLLULRZNJUHYTEE-UHFFFAOYSA-N
XLogP-0.03
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 5-0.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-1,8-diazaspiro[3.5]nonan-2-one?
The IUPAC name of 8-methyl-1,8-diazaspiro[3.5]nonan-2-one (CID 169184407) is 8-methyl-1,8-diazaspiro[3.5]nonan-2-one.
What is the SMILES notation for 8-methyl-1,8-diazaspiro[3.5]nonan-2-one?
The canonical SMILES for 8-methyl-1,8-diazaspiro[3.5]nonan-2-one is CN1CCCC2(CC(=O)N2)C1.
What is the InChIKey of 8-methyl-1,8-diazaspiro[3.5]nonan-2-one?
The InChIKey is LLULRZNJUHYTEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c1-10-4-2-3-8(6-10)5-7(11)9-8/h2-6H2,1H3,(H,9,11).
What are the key properties of 8-methyl-1,8-diazaspiro[3.5]nonan-2-one?
8-methyl-1,8-diazaspiro[3.5]nonan-2-one has a molecular weight of 154.21 g/mol, XLogP of -0.03, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-1,8-diazaspiro[3.5]nonan-2-one is sourced from PubChem (CID 169184407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).