2-[4-(hydroxymethyl)-2-azaspiro[4.4]nonan-2-yl]ethanol

C11H21NO2 — CID 121202805

IUPAC2-[4-(hydroxymethyl)-2-azaspiro[4.4]nonan-2-yl]ethanol
SMILESOCCN1CC(CO)C2(CCCC2)C1
InChIInChI=1S/C11H21NO2/c13-6-5-12-7-10(8-14)11(9-12)3-1-2-4-11/h10,13-14H,1-9H2
InChIKeyIZAOBTCXRBDEOM-UHFFFAOYSA-N
MW199.29 g/mol
LogP0.46
Rot. Bonds3

About 2-[4-(hydroxymethyl)-2-azaspiro[4.4]nonan-2-yl]ethanol

2-[4-(hydroxymethyl)-2-azaspiro[4.4]nonan-2-yl]ethanol (PubChem CID 121202805) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 2-[4-(hydroxymethyl)-2-azaspiro[4.4]nonan-2-yl]ethanol.

Molecular Properties

Compound Name2-[4-(hydroxymethyl)-2-azaspiro[4.4]nonan-2-yl]ethanol
PubChem CID121202805
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name2-[4-(hydroxymethyl)-2-azaspiro[4.4]nonan-2-yl]ethanol
SMILESOCCN1CC(CO)C2(CCCC2)C1
InChIInChI=1S/C11H21NO2/c13-6-5-12-7-10(8-14)11(9-12)3-1-2-4-11/h10,13-14H,1-9H2
InChIKeyIZAOBTCXRBDEOM-UHFFFAOYSA-N
XLogP0.46
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(hydroxymethyl)-2-azaspiro[4.4]nonan-2-yl]ethanol?
The IUPAC name of 2-[4-(hydroxymethyl)-2-azaspiro[4.4]nonan-2-yl]ethanol (CID 121202805) is 2-[4-(hydroxymethyl)-2-azaspiro[4.4]nonan-2-yl]ethanol.
What is the SMILES notation for 2-[4-(hydroxymethyl)-2-azaspiro[4.4]nonan-2-yl]ethanol?
The canonical SMILES for 2-[4-(hydroxymethyl)-2-azaspiro[4.4]nonan-2-yl]ethanol is OCCN1CC(CO)C2(CCCC2)C1.
What is the InChIKey of 2-[4-(hydroxymethyl)-2-azaspiro[4.4]nonan-2-yl]ethanol?
The InChIKey is IZAOBTCXRBDEOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c13-6-5-12-7-10(8-14)11(9-12)3-1-2-4-11/h10,13-14H,1-9H2.
What are the key properties of 2-[4-(hydroxymethyl)-2-azaspiro[4.4]nonan-2-yl]ethanol?
2-[4-(hydroxymethyl)-2-azaspiro[4.4]nonan-2-yl]ethanol has a molecular weight of 199.29 g/mol, XLogP of 0.46, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(hydroxymethyl)-2-azaspiro[4.4]nonan-2-yl]ethanol is sourced from PubChem (CID 121202805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).