2-amino-2-(5-oxaspiro[3.5]nonan-8-yl)ethanol

C10H19NO2 — CID 79922665

IUPAC2-amino-2-(5-oxaspiro[3.5]nonan-8-yl)ethanol
SMILESNC(CO)C1CCOC2(CCC2)C1
InChIInChI=1S/C10H19NO2/c11-9(7-12)8-2-5-13-10(6-8)3-1-4-10/h8-9,12H,1-7,11H2
InChIKeyPSAZODYCHMWCJL-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.66
Rot. Bonds2

About 2-amino-2-(5-oxaspiro[3.5]nonan-8-yl)ethanol

2-amino-2-(5-oxaspiro[3.5]nonan-8-yl)ethanol (PubChem CID 79922665) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 2-amino-2-(5-oxaspiro[3.5]nonan-8-yl)ethanol.

Molecular Properties

Compound Name2-amino-2-(5-oxaspiro[3.5]nonan-8-yl)ethanol
PubChem CID79922665
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name2-amino-2-(5-oxaspiro[3.5]nonan-8-yl)ethanol
SMILESNC(CO)C1CCOC2(CCC2)C1
InChIInChI=1S/C10H19NO2/c11-9(7-12)8-2-5-13-10(6-8)3-1-4-10/h8-9,12H,1-7,11H2
InChIKeyPSAZODYCHMWCJL-UHFFFAOYSA-N
XLogP0.66
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(5-oxaspiro[3.5]nonan-8-yl)ethanol?
The IUPAC name of 2-amino-2-(5-oxaspiro[3.5]nonan-8-yl)ethanol (CID 79922665) is 2-amino-2-(5-oxaspiro[3.5]nonan-8-yl)ethanol.
What is the SMILES notation for 2-amino-2-(5-oxaspiro[3.5]nonan-8-yl)ethanol?
The canonical SMILES for 2-amino-2-(5-oxaspiro[3.5]nonan-8-yl)ethanol is NC(CO)C1CCOC2(CCC2)C1.
What is the InChIKey of 2-amino-2-(5-oxaspiro[3.5]nonan-8-yl)ethanol?
The InChIKey is PSAZODYCHMWCJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c11-9(7-12)8-2-5-13-10(6-8)3-1-4-10/h8-9,12H,1-7,11H2.
What are the key properties of 2-amino-2-(5-oxaspiro[3.5]nonan-8-yl)ethanol?
2-amino-2-(5-oxaspiro[3.5]nonan-8-yl)ethanol has a molecular weight of 185.27 g/mol, XLogP of 0.66, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(5-oxaspiro[3.5]nonan-8-yl)ethanol is sourced from PubChem (CID 79922665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).