2-amino-2-methyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one

C13H23NO2 — CID 116560117

IUPAC2-amino-2-methyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one
SMILESCC(C)(N)C(=O)C1CCOC2(CCCC2)C1
InChIInChI=1S/C13H23NO2/c1-12(2,14)11(15)10-5-8-16-13(9-10)6-3-4-7-13/h10H,3-9,14H2,1-2H3
InChIKeyFYPZJAMDMSIQKC-UHFFFAOYSA-N
MW225.33 g/mol
LogP2.03
Rot. Bonds2

About 2-amino-2-methyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one

2-amino-2-methyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one (PubChem CID 116560117) has the molecular formula C13H23NO2 and a molecular weight of 225.33 g/mol. Its IUPAC name is 2-amino-2-methyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one.

Molecular Properties

Compound Name2-amino-2-methyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one
PubChem CID116560117
Molecular FormulaC13H23NO2
Molecular Weight225.33 g/mol
Exact Mass225.17
IUPAC Name2-amino-2-methyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one
SMILESCC(C)(N)C(=O)C1CCOC2(CCCC2)C1
InChIInChI=1S/C13H23NO2/c1-12(2,14)11(15)10-5-8-16-13(9-10)6-3-4-7-13/h10H,3-9,14H2,1-2H3
InChIKeyFYPZJAMDMSIQKC-UHFFFAOYSA-N
XLogP2.03
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-2,2-dimethyl-1-(1-oxaspiro[5.5]undecan-4-yl)propan-1-one
CID 116599992
2-hydroxy-2-methyl-1-(6-oxaspiro[4.5]decan-9-yl)butan-1-one
CID 103446684
2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-2-piperidin-1-ylpropan-1-one
CID 79921640
2-methoxy-2-methyl-1-(6-oxaspiro[4.5]decan-9-yl)butan-1-one
CID 116746779
2,2-dimethyl-1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)propan-1-one
CID 79913238
2-amino-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one
CID 116551698
1-oxaspiro[5.5]undecane-4-carboxylic acid
CID 79904011
2-amino-1-(1-oxaspiro[5.5]undecan-4-yl)propan-1-one
CID 116551697
2-ethoxy-2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)butan-1-one
CID 116746985
cyclopentyl(6-oxaspiro[4.5]decan-9-yl)methanone
CID 79913745
2-hydroxy-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one
CID 103451398
(1-aminocyclobutyl)-(6-oxaspiro[4.5]decan-9-yl)methanone
CID 116598404

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one?
The IUPAC name of 2-amino-2-methyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one (CID 116560117) is 2-amino-2-methyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one.
What is the SMILES notation for 2-amino-2-methyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one?
The canonical SMILES for 2-amino-2-methyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one is CC(C)(N)C(=O)C1CCOC2(CCCC2)C1.
What is the InChIKey of 2-amino-2-methyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one?
The InChIKey is FYPZJAMDMSIQKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO2/c1-12(2,14)11(15)10-5-8-16-13(9-10)6-3-4-7-13/h10H,3-9,14H2,1-2H3.
What are the key properties of 2-amino-2-methyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one?
2-amino-2-methyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one has a molecular weight of 225.33 g/mol, XLogP of 2.03, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one is sourced from PubChem (CID 116560117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).