8-cyclopentyl-8-(dimethylamino)-2-azaspiro[4.5]decan-3-one

C16H28N2O — CID 118662010

IUPAC8-cyclopentyl-8-(dimethylamino)-2-azaspiro[4.5]decan-3-one
SMILESCN(C)C1(C2CCCC2)CCC2(CC1)CNC(=O)C2
InChIInChI=1S/C16H28N2O/c1-18(2)16(13-5-3-4-6-13)9-7-15(8-10-16)11-14(19)17-12-15/h13H,3-12H2,1-2H3,(H,17,19)
InChIKeyIMSFEVRDSQWXJE-UHFFFAOYSA-N
MW264.41 g/mol
LogP2.56
Rot. Bonds2

About 8-cyclopentyl-8-(dimethylamino)-2-azaspiro[4.5]decan-3-one

8-cyclopentyl-8-(dimethylamino)-2-azaspiro[4.5]decan-3-one (PubChem CID 118662010) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is 8-cyclopentyl-8-(dimethylamino)-2-azaspiro[4.5]decan-3-one.

Molecular Properties

Compound Name8-cyclopentyl-8-(dimethylamino)-2-azaspiro[4.5]decan-3-one
PubChem CID118662010
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC Name8-cyclopentyl-8-(dimethylamino)-2-azaspiro[4.5]decan-3-one
SMILESCN(C)C1(C2CCCC2)CCC2(CC1)CNC(=O)C2
InChIInChI=1S/C16H28N2O/c1-18(2)16(13-5-3-4-6-13)9-7-15(8-10-16)11-14(19)17-12-15/h13H,3-12H2,1-2H3,(H,17,19)
InChIKeyIMSFEVRDSQWXJE-UHFFFAOYSA-N
XLogP2.56
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-cyclopentyl-8-(dimethylamino)-2-azaspiro[4.5]decan-3-one?
The IUPAC name of 8-cyclopentyl-8-(dimethylamino)-2-azaspiro[4.5]decan-3-one (CID 118662010) is 8-cyclopentyl-8-(dimethylamino)-2-azaspiro[4.5]decan-3-one.
What is the SMILES notation for 8-cyclopentyl-8-(dimethylamino)-2-azaspiro[4.5]decan-3-one?
The canonical SMILES for 8-cyclopentyl-8-(dimethylamino)-2-azaspiro[4.5]decan-3-one is CN(C)C1(C2CCCC2)CCC2(CC1)CNC(=O)C2.
What is the InChIKey of 8-cyclopentyl-8-(dimethylamino)-2-azaspiro[4.5]decan-3-one?
The InChIKey is IMSFEVRDSQWXJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c1-18(2)16(13-5-3-4-6-13)9-7-15(8-10-16)11-14(19)17-12-15/h13H,3-12H2,1-2H3,(H,17,19).
What are the key properties of 8-cyclopentyl-8-(dimethylamino)-2-azaspiro[4.5]decan-3-one?
8-cyclopentyl-8-(dimethylamino)-2-azaspiro[4.5]decan-3-one has a molecular weight of 264.41 g/mol, XLogP of 2.56, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-cyclopentyl-8-(dimethylamino)-2-azaspiro[4.5]decan-3-one is sourced from PubChem (CID 118662010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).