2-methyl-2,7-diazaspiro[4.4]nonan-3-one

C8H14N2O — CID 23111901

IUPAC2-methyl-2,7-diazaspiro[4.4]nonan-3-one
SMILESCN1CC2(CCNC2)CC1=O
InChIInChI=1S/C8H14N2O/c1-10-6-8(4-7(10)11)2-3-9-5-8/h9H,2-6H2,1H3
InChIKeyJGDVUWLOZFRKES-UHFFFAOYSA-N
MW154.21 g/mol
LogP-0.17
Rot. Bonds

About 2-methyl-2,7-diazaspiro[4.4]nonan-3-one

2-methyl-2,7-diazaspiro[4.4]nonan-3-one (PubChem CID 23111901) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is 2-methyl-2,7-diazaspiro[4.4]nonan-3-one.

Molecular Properties

Compound Name2-methyl-2,7-diazaspiro[4.4]nonan-3-one
PubChem CID23111901
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name2-methyl-2,7-diazaspiro[4.4]nonan-3-one
SMILESCN1CC2(CCNC2)CC1=O
InChIInChI=1S/C8H14N2O/c1-10-6-8(4-7(10)11)2-3-9-5-8/h9H,2-6H2,1H3
InChIKeyJGDVUWLOZFRKES-UHFFFAOYSA-N
XLogP-0.17
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 ≤ 5-0.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2,7-diazaspiro[4.4]nonan-3-one?
The IUPAC name of 2-methyl-2,7-diazaspiro[4.4]nonan-3-one (CID 23111901) is 2-methyl-2,7-diazaspiro[4.4]nonan-3-one.
What is the SMILES notation for 2-methyl-2,7-diazaspiro[4.4]nonan-3-one?
The canonical SMILES for 2-methyl-2,7-diazaspiro[4.4]nonan-3-one is CN1CC2(CCNC2)CC1=O.
What is the InChIKey of 2-methyl-2,7-diazaspiro[4.4]nonan-3-one?
The InChIKey is JGDVUWLOZFRKES-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c1-10-6-8(4-7(10)11)2-3-9-5-8/h9H,2-6H2,1H3.
What are the key properties of 2-methyl-2,7-diazaspiro[4.4]nonan-3-one?
2-methyl-2,7-diazaspiro[4.4]nonan-3-one has a molecular weight of 154.21 g/mol, XLogP of -0.17, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2,7-diazaspiro[4.4]nonan-3-one is sourced from PubChem (CID 23111901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).