2-(4-azaspiro[2.4]heptan-2-yl)ethanol

C8H15NO — CID 90022762

IUPAC2-(4-azaspiro[2.4]heptan-2-yl)ethanol
SMILESOCCC1CC12CCCN2
InChIInChI=1S/C8H15NO/c10-5-2-7-6-8(7)3-1-4-9-8/h7,9-10H,1-6H2
InChIKeyAIHYEMCIHTZZCR-UHFFFAOYSA-N
MW141.21 g/mol
LogP0.51
Rot. Bonds2

About 2-(4-azaspiro[2.4]heptan-2-yl)ethanol

2-(4-azaspiro[2.4]heptan-2-yl)ethanol (PubChem CID 90022762) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 2-(4-azaspiro[2.4]heptan-2-yl)ethanol.

Molecular Properties

Compound Name2-(4-azaspiro[2.4]heptan-2-yl)ethanol
PubChem CID90022762
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name2-(4-azaspiro[2.4]heptan-2-yl)ethanol
SMILESOCCC1CC12CCCN2
InChIInChI=1S/C8H15NO/c10-5-2-7-6-8(7)3-1-4-9-8/h7,9-10H,1-6H2
InChIKeyAIHYEMCIHTZZCR-UHFFFAOYSA-N
XLogP0.51
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-azaspiro[2.4]heptan-2-yl)ethanol?
The IUPAC name of 2-(4-azaspiro[2.4]heptan-2-yl)ethanol (CID 90022762) is 2-(4-azaspiro[2.4]heptan-2-yl)ethanol.
What is the SMILES notation for 2-(4-azaspiro[2.4]heptan-2-yl)ethanol?
The canonical SMILES for 2-(4-azaspiro[2.4]heptan-2-yl)ethanol is OCCC1CC12CCCN2.
What is the InChIKey of 2-(4-azaspiro[2.4]heptan-2-yl)ethanol?
The InChIKey is AIHYEMCIHTZZCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c10-5-2-7-6-8(7)3-1-4-9-8/h7,9-10H,1-6H2.
What are the key properties of 2-(4-azaspiro[2.4]heptan-2-yl)ethanol?
2-(4-azaspiro[2.4]heptan-2-yl)ethanol has a molecular weight of 141.21 g/mol, XLogP of 0.51, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-azaspiro[2.4]heptan-2-yl)ethanol is sourced from PubChem (CID 90022762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).