2-(3,3-dimethylmorpholin-4-yl)ethanol

C8H17NO2 — CID 22342910

IUPAC2-(3,3-dimethylmorpholin-4-yl)ethanol
SMILESCC1(C)COCCN1CCO
InChIInChI=1S/C8H17NO2/c1-8(2)7-11-6-4-9(8)3-5-10/h10H,3-7H2,1-2H3
InChIKeyYTRWCRKQXOMASA-UHFFFAOYSA-N
MW159.23 g/mol
LogP0.09
Rot. Bonds2

About 2-(3,3-dimethylmorpholin-4-yl)ethanol

2-(3,3-dimethylmorpholin-4-yl)ethanol (PubChem CID 22342910) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is 2-(3,3-dimethylmorpholin-4-yl)ethanol.

Molecular Properties

Compound Name2-(3,3-dimethylmorpholin-4-yl)ethanol
PubChem CID22342910
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC Name2-(3,3-dimethylmorpholin-4-yl)ethanol
SMILESCC1(C)COCCN1CCO
InChIInChI=1S/C8H17NO2/c1-8(2)7-11-6-4-9(8)3-5-10/h10H,3-7H2,1-2H3
InChIKeyYTRWCRKQXOMASA-UHFFFAOYSA-N
XLogP0.09
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3,3-dimethylmorpholin-4-yl)ethanol?
The IUPAC name of 2-(3,3-dimethylmorpholin-4-yl)ethanol (CID 22342910) is 2-(3,3-dimethylmorpholin-4-yl)ethanol.
What is the SMILES notation for 2-(3,3-dimethylmorpholin-4-yl)ethanol?
The canonical SMILES for 2-(3,3-dimethylmorpholin-4-yl)ethanol is CC1(C)COCCN1CCO.
What is the InChIKey of 2-(3,3-dimethylmorpholin-4-yl)ethanol?
The InChIKey is YTRWCRKQXOMASA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2/c1-8(2)7-11-6-4-9(8)3-5-10/h10H,3-7H2,1-2H3.
What are the key properties of 2-(3,3-dimethylmorpholin-4-yl)ethanol?
2-(3,3-dimethylmorpholin-4-yl)ethanol has a molecular weight of 159.23 g/mol, XLogP of 0.09, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,3-dimethylmorpholin-4-yl)ethanol is sourced from PubChem (CID 22342910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).