2-azaspiro[4.5]decan-8-one

C9H15NO — CID 68652733

IUPAC2-azaspiro[4.5]decan-8-one
SMILESO=C1CCC2(CCNC2)CC1
InChIInChI=1S/C9H15NO/c11-8-1-3-9(4-2-8)5-6-10-7-9/h10H,1-7H2
InChIKeyAVUVNDJIVWTFQQ-UHFFFAOYSA-N
MW153.22 g/mol
LogP1.11
Rot. Bonds

About 2-azaspiro[4.5]decan-8-one

2-azaspiro[4.5]decan-8-one (PubChem CID 68652733) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is 2-azaspiro[4.5]decan-8-one.

Molecular Properties

Compound Name2-azaspiro[4.5]decan-8-one
PubChem CID68652733
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC Name2-azaspiro[4.5]decan-8-one
SMILESO=C1CCC2(CCNC2)CC1
InChIInChI=1S/C9H15NO/c11-8-1-3-9(4-2-8)5-6-10-7-9/h10H,1-7H2
InChIKeyAVUVNDJIVWTFQQ-UHFFFAOYSA-N
XLogP1.11
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-azaspiro[4.5]decan-8-one?
The IUPAC name of 2-azaspiro[4.5]decan-8-one (CID 68652733) is 2-azaspiro[4.5]decan-8-one.
What is the SMILES notation for 2-azaspiro[4.5]decan-8-one?
The canonical SMILES for 2-azaspiro[4.5]decan-8-one is O=C1CCC2(CCNC2)CC1.
What is the InChIKey of 2-azaspiro[4.5]decan-8-one?
The InChIKey is AVUVNDJIVWTFQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c11-8-1-3-9(4-2-8)5-6-10-7-9/h10H,1-7H2.
What are the key properties of 2-azaspiro[4.5]decan-8-one?
2-azaspiro[4.5]decan-8-one has a molecular weight of 153.22 g/mol, XLogP of 1.11, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-azaspiro[4.5]decan-8-one is sourced from PubChem (CID 68652733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).