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

C13H25NO2 — CID 79919770

IUPAC2-[5-oxaspiro[3.5]nonan-8-yl(propyl)amino]ethanol
SMILESCCCN(CCO)C1CCOC2(CCC2)C1
InChIInChI=1S/C13H25NO2/c1-2-7-14(8-9-15)12-4-10-16-13(11-12)5-3-6-13/h12,15H,2-11H2,1H3
InChIKeyFIWQWJVJNINDDA-UHFFFAOYSA-N
MW227.35 g/mol
LogP1.79
Rot. Bonds5

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

2-[5-oxaspiro[3.5]nonan-8-yl(propyl)amino]ethanol (PubChem CID 79919770) has the molecular formula C13H25NO2 and a molecular weight of 227.35 g/mol. Its IUPAC name is 2-[5-oxaspiro[3.5]nonan-8-yl(propyl)amino]ethanol.

Molecular Properties

Compound Name2-[5-oxaspiro[3.5]nonan-8-yl(propyl)amino]ethanol
PubChem CID79919770
Molecular FormulaC13H25NO2
Molecular Weight227.35 g/mol
Exact Mass227.19
IUPAC Name2-[5-oxaspiro[3.5]nonan-8-yl(propyl)amino]ethanol
SMILESCCCN(CCO)C1CCOC2(CCC2)C1
InChIInChI=1S/C13H25NO2/c1-2-7-14(8-9-15)12-4-10-16-13(11-12)5-3-6-13/h12,15H,2-11H2,1H3
InChIKeyFIWQWJVJNINDDA-UHFFFAOYSA-N
XLogP1.79
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[5-oxaspiro[3.5]nonan-8-yl(propyl)amino]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[6-oxaspiro[4.5]decan-9-yl(propyl)amino]ethanol
CID 79919654
2-[2-hydroxyethyl(1-oxaspiro[5.5]undecan-4-yl)amino]ethanol
CID 79920437
2-[1-oxa-9-thiaspiro[5.5]undecan-4-yl(propyl)amino]ethanol
CID 79919655
2-[5-oxaspiro[3.5]nonan-8-yl(propyl)amino]acetic acid
CID 79894587
2-[butyl(1,9-dioxaspiro[5.5]undecan-4-yl)amino]ethanol
CID 79919295
N'-(6-oxaspiro[4.5]decan-9-yl)-N'-propylpropane-1,3-diamine
CID 79904792
2-[6-oxaspiro[4.5]decan-9-yl(propyl)amino]acetonitrile
CID 79903017
2-[5-oxaspiro[3.5]nonan-8-yl(pentan-3-yl)amino]ethanol
CID 79919992
N'-butyl-N'-(5-oxaspiro[3.5]nonan-8-yl)ethane-1,2-diamine
CID 79920705
2,2-dimethyl-N'-(5-oxaspiro[3.5]nonan-8-yl)-N'-propylpropane-1,3-diamine
CID 79898830
N-propyl-N-(pyrrolidin-2-ylmethyl)-5-oxaspiro[3.5]nonan-8-amine
CID 106615927
2-[1-oxaspiro[5.5]undecan-4-yl(pentan-3-yl)amino]ethanol
CID 79919415

Frequently Asked Questions

What is the IUPAC name of 2-[5-oxaspiro[3.5]nonan-8-yl(propyl)amino]ethanol?
The IUPAC name of 2-[5-oxaspiro[3.5]nonan-8-yl(propyl)amino]ethanol (CID 79919770) is 2-[5-oxaspiro[3.5]nonan-8-yl(propyl)amino]ethanol.
What is the SMILES notation for 2-[5-oxaspiro[3.5]nonan-8-yl(propyl)amino]ethanol?
The canonical SMILES for 2-[5-oxaspiro[3.5]nonan-8-yl(propyl)amino]ethanol is CCCN(CCO)C1CCOC2(CCC2)C1.
What is the InChIKey of 2-[5-oxaspiro[3.5]nonan-8-yl(propyl)amino]ethanol?
The InChIKey is FIWQWJVJNINDDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO2/c1-2-7-14(8-9-15)12-4-10-16-13(11-12)5-3-6-13/h12,15H,2-11H2,1H3.
What are the key properties of 2-[5-oxaspiro[3.5]nonan-8-yl(propyl)amino]ethanol?
2-[5-oxaspiro[3.5]nonan-8-yl(propyl)amino]ethanol has a molecular weight of 227.35 g/mol, XLogP of 1.79, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-oxaspiro[3.5]nonan-8-yl(propyl)amino]ethanol is sourced from PubChem (CID 79919770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).