2-(2-oxa-7-azaspiro[3.5]nonan-7-yl)ethanamine

C9H18N2O — CID 83959904

IUPAC2-(2-oxa-7-azaspiro[3.5]nonan-7-yl)ethanamine
SMILESNCCN1CCC2(CC1)COC2
InChIInChI=1S/C9H18N2O/c10-3-6-11-4-1-9(2-5-11)7-12-8-9/h1-8,10H2
InChIKeyHDQFOUDATNQMKB-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.06
Rot. Bonds2

About 2-(2-oxa-7-azaspiro[3.5]nonan-7-yl)ethanamine

2-(2-oxa-7-azaspiro[3.5]nonan-7-yl)ethanamine (PubChem CID 83959904) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is 2-(2-oxa-7-azaspiro[3.5]nonan-7-yl)ethanamine.

Molecular Properties

Compound Name2-(2-oxa-7-azaspiro[3.5]nonan-7-yl)ethanamine
PubChem CID83959904
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name2-(2-oxa-7-azaspiro[3.5]nonan-7-yl)ethanamine
SMILESNCCN1CCC2(CC1)COC2
InChIInChI=1S/C9H18N2O/c10-3-6-11-4-1-9(2-5-11)7-12-8-9/h1-8,10H2
InChIKeyHDQFOUDATNQMKB-UHFFFAOYSA-N
XLogP0.06
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-oxa-7-azaspiro[3.5]nonan-7-yl)ethanamine?
The IUPAC name of 2-(2-oxa-7-azaspiro[3.5]nonan-7-yl)ethanamine (CID 83959904) is 2-(2-oxa-7-azaspiro[3.5]nonan-7-yl)ethanamine.
What is the SMILES notation for 2-(2-oxa-7-azaspiro[3.5]nonan-7-yl)ethanamine?
The canonical SMILES for 2-(2-oxa-7-azaspiro[3.5]nonan-7-yl)ethanamine is NCCN1CCC2(CC1)COC2.
What is the InChIKey of 2-(2-oxa-7-azaspiro[3.5]nonan-7-yl)ethanamine?
The InChIKey is HDQFOUDATNQMKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c10-3-6-11-4-1-9(2-5-11)7-12-8-9/h1-8,10H2.
What are the key properties of 2-(2-oxa-7-azaspiro[3.5]nonan-7-yl)ethanamine?
2-(2-oxa-7-azaspiro[3.5]nonan-7-yl)ethanamine has a molecular weight of 170.26 g/mol, XLogP of 0.06, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxa-7-azaspiro[3.5]nonan-7-yl)ethanamine is sourced from PubChem (CID 83959904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).