2-[6-oxaspiro[4.5]decan-9-yl(propyl)amino]ethanol

C14H27NO2 — CID 79919654

IUPAC2-[6-oxaspiro[4.5]decan-9-yl(propyl)amino]ethanol
SMILESCCCN(CCO)C1CCOC2(CCCC2)C1
InChIInChI=1S/C14H27NO2/c1-2-8-15(9-10-16)13-5-11-17-14(12-13)6-3-4-7-14/h13,16H,2-12H2,1H3
InChIKeyWOXANALGRCBOBM-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.18
Rot. Bonds5

About 2-[6-oxaspiro[4.5]decan-9-yl(propyl)amino]ethanol

2-[6-oxaspiro[4.5]decan-9-yl(propyl)amino]ethanol (PubChem CID 79919654) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is 2-[6-oxaspiro[4.5]decan-9-yl(propyl)amino]ethanol.

Molecular Properties

Compound Name2-[6-oxaspiro[4.5]decan-9-yl(propyl)amino]ethanol
PubChem CID79919654
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC Name2-[6-oxaspiro[4.5]decan-9-yl(propyl)amino]ethanol
SMILESCCCN(CCO)C1CCOC2(CCCC2)C1
InChIInChI=1S/C14H27NO2/c1-2-8-15(9-10-16)13-5-11-17-14(12-13)6-3-4-7-14/h13,16H,2-12H2,1H3
InChIKeyWOXANALGRCBOBM-UHFFFAOYSA-N
XLogP2.18
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[5-oxaspiro[3.5]nonan-8-yl(propyl)amino]ethanol
CID 79919770
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
N'-(6-oxaspiro[4.5]decan-9-yl)-N'-propylpropane-1,3-diamine
CID 79904792
2-[butyl(1,9-dioxaspiro[5.5]undecan-4-yl)amino]ethanol
CID 79919295
2-[6-oxaspiro[4.5]decan-9-yl(propyl)amino]acetonitrile
CID 79903017
2-[5-oxaspiro[3.5]nonan-8-yl(propyl)amino]acetic acid
CID 79894587
2-[1-oxaspiro[5.5]undecan-4-yl(pentan-3-yl)amino]ethanol
CID 79919415
N-propyl-N-(pyrrolidin-2-ylmethyl)-6-oxaspiro[4.5]decan-9-amine
CID 106615997
N'-ethyl-N'-(6-oxaspiro[4.5]decan-9-yl)ethane-1,2-diamine
CID 79898283
N'-butyl-N'-(5-oxaspiro[3.5]nonan-8-yl)ethane-1,2-diamine
CID 79920705
2-[5-oxaspiro[3.5]nonan-8-yl(pentan-3-yl)amino]ethanol
CID 79919992

Frequently Asked Questions

What is the IUPAC name of 2-[6-oxaspiro[4.5]decan-9-yl(propyl)amino]ethanol?
The IUPAC name of 2-[6-oxaspiro[4.5]decan-9-yl(propyl)amino]ethanol (CID 79919654) is 2-[6-oxaspiro[4.5]decan-9-yl(propyl)amino]ethanol.
What is the SMILES notation for 2-[6-oxaspiro[4.5]decan-9-yl(propyl)amino]ethanol?
The canonical SMILES for 2-[6-oxaspiro[4.5]decan-9-yl(propyl)amino]ethanol is CCCN(CCO)C1CCOC2(CCCC2)C1.
What is the InChIKey of 2-[6-oxaspiro[4.5]decan-9-yl(propyl)amino]ethanol?
The InChIKey is WOXANALGRCBOBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-2-8-15(9-10-16)13-5-11-17-14(12-13)6-3-4-7-14/h13,16H,2-12H2,1H3.
What are the key properties of 2-[6-oxaspiro[4.5]decan-9-yl(propyl)amino]ethanol?
2-[6-oxaspiro[4.5]decan-9-yl(propyl)amino]ethanol has a molecular weight of 241.37 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-oxaspiro[4.5]decan-9-yl(propyl)amino]ethanol is sourced from PubChem (CID 79919654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).