3-amino-1-(2-azaspiro[4.5]decan-2-yl)propan-1-one

C12H22N2O — CID 83628810

IUPAC3-amino-1-(2-azaspiro[4.5]decan-2-yl)propan-1-one
SMILESNCCC(=O)N1CCC2(CCCCC2)C1
InChIInChI=1S/C12H22N2O/c13-8-4-11(15)14-9-7-12(10-14)5-2-1-3-6-12/h1-10,13H2
InChIKeyJKZNZZUSNWGSGJ-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.52
Rot. Bonds2

About 3-amino-1-(2-azaspiro[4.5]decan-2-yl)propan-1-one

3-amino-1-(2-azaspiro[4.5]decan-2-yl)propan-1-one (PubChem CID 83628810) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is 3-amino-1-(2-azaspiro[4.5]decan-2-yl)propan-1-one.

Molecular Properties

Compound Name3-amino-1-(2-azaspiro[4.5]decan-2-yl)propan-1-one
PubChem CID83628810
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name3-amino-1-(2-azaspiro[4.5]decan-2-yl)propan-1-one
SMILESNCCC(=O)N1CCC2(CCCCC2)C1
InChIInChI=1S/C12H22N2O/c13-8-4-11(15)14-9-7-12(10-14)5-2-1-3-6-12/h1-10,13H2
InChIKeyJKZNZZUSNWGSGJ-UHFFFAOYSA-N
XLogP1.52
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-1-(3-azaspiro[5.5]undecan-3-yl)propan-1-one
CID 62937582
3-(2-aminoethoxy)-1-(2-azaspiro[4.4]nonan-2-yl)propan-1-one
CID 112739108
1-(6-azaspiro[3.4]octan-6-yl)-2-chloroethanone
CID 130670155
3-amino-1-(3-hydroxy-3-methylpyrrolidin-1-yl)propan-1-one
CID 103355732
3-(2-azaspiro[4.4]nonan-2-yl)-3-oxopropanenitrile
CID 130168272
(5S)-5-[3-(2-azaspiro[4.4]nonan-2-yl)-3-oxopropyl]imidazolidine-2,4-dione
CID 131945019
2-(4-aminophenyl)-1-(2-azaspiro[4.5]decan-2-yl)ethanone
CID 119805305
1-(5-azaspiro[2.5]octan-5-yl)butan-1-one
CID 130890888
3-amino-1-[3-hydroxy-3-(trifluoromethyl)pyrrolidin-1-yl]propan-1-one
CID 119333364
3-amino-1-(aziridin-1-yl)propan-1-one
CID 87106938
5-(3-azaspiro[5.5]undecan-3-yl)-5-oxopentanoic acid
CID 62936546
6-(3-azaspiro[5.5]undecan-3-yl)-6-oxohexanoic acid
CID 62936033

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(2-azaspiro[4.5]decan-2-yl)propan-1-one?
The IUPAC name of 3-amino-1-(2-azaspiro[4.5]decan-2-yl)propan-1-one (CID 83628810) is 3-amino-1-(2-azaspiro[4.5]decan-2-yl)propan-1-one.
What is the SMILES notation for 3-amino-1-(2-azaspiro[4.5]decan-2-yl)propan-1-one?
The canonical SMILES for 3-amino-1-(2-azaspiro[4.5]decan-2-yl)propan-1-one is NCCC(=O)N1CCC2(CCCCC2)C1.
What is the InChIKey of 3-amino-1-(2-azaspiro[4.5]decan-2-yl)propan-1-one?
The InChIKey is JKZNZZUSNWGSGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c13-8-4-11(15)14-9-7-12(10-14)5-2-1-3-6-12/h1-10,13H2.
What are the key properties of 3-amino-1-(2-azaspiro[4.5]decan-2-yl)propan-1-one?
3-amino-1-(2-azaspiro[4.5]decan-2-yl)propan-1-one has a molecular weight of 210.32 g/mol, XLogP of 1.52, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(2-azaspiro[4.5]decan-2-yl)propan-1-one is sourced from PubChem (CID 83628810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).