2-(2,2-dimethylmorpholin-4-yl)-1-(oxolan-3-yl)ethanol

C12H23NO3 — CID 104752564

IUPAC2-(2,2-dimethylmorpholin-4-yl)-1-(oxolan-3-yl)ethanol
SMILESCC1(C)CN(CC(O)C2CCOC2)CCO1
InChIInChI=1S/C12H23NO3/c1-12(2)9-13(4-6-16-12)7-11(14)10-3-5-15-8-10/h10-11,14H,3-9H2,1-2H3
InChIKeyKDTDPQUIDKMCCG-UHFFFAOYSA-N
MW229.32 g/mol
LogP0.49
Rot. Bonds3

About 2-(2,2-dimethylmorpholin-4-yl)-1-(oxolan-3-yl)ethanol

2-(2,2-dimethylmorpholin-4-yl)-1-(oxolan-3-yl)ethanol (PubChem CID 104752564) has the molecular formula C12H23NO3 and a molecular weight of 229.32 g/mol. Its IUPAC name is 2-(2,2-dimethylmorpholin-4-yl)-1-(oxolan-3-yl)ethanol.

Molecular Properties

Compound Name2-(2,2-dimethylmorpholin-4-yl)-1-(oxolan-3-yl)ethanol
PubChem CID104752564
Molecular FormulaC12H23NO3
Molecular Weight229.32 g/mol
Exact Mass229.17
IUPAC Name2-(2,2-dimethylmorpholin-4-yl)-1-(oxolan-3-yl)ethanol
SMILESCC1(C)CN(CC(O)C2CCOC2)CCO1
InChIInChI=1S/C12H23NO3/c1-12(2)9-13(4-6-16-12)7-11(14)10-3-5-15-8-10/h10-11,14H,3-9H2,1-2H3
InChIKeyKDTDPQUIDKMCCG-UHFFFAOYSA-N
XLogP0.49
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(oxolan-3-yl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanol
CID 102745374
2-(4-ethylazepan-1-yl)-1-(oxolan-3-yl)ethanol
CID 104752932
1-cyclopropyl-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanol
CID 102745370
2-(2-methylpyrrolidin-1-yl)-1-(oxolan-3-yl)ethanol
CID 104752366
1-(2,2-dimethylmorpholin-4-yl)-3-(2-methoxyethylamino)propan-2-ol
CID 113317455
1-(2,2-dimethylmorpholin-4-yl)-3,3-dimethylbutan-2-amine
CID 43592748
1-[2-hydroxy-2-(oxolan-3-yl)ethyl]-3,4-dimethylpyrrolidine-2,5-dione
CID 104753310
N-(dicyclopropylmethyl)-2-(2,2-dimethylmorpholin-4-yl)ethanamine
CID 62561005
(1S)-2-bromo-1-[(3S)-oxolan-3-yl]ethanol
CID 124679633
(1S)-2-amino-1-[(3R)-oxolan-3-yl]ethanol
CID 93046962
1-(2,2-dimethylmorpholin-4-yl)-3-phenylmethoxypropan-2-ol
CID 60761061
2-(3,3-dimethylpyrrolidin-1-yl)-N-ethyl-1-(oxolan-3-yl)ethanamine
CID 113448329

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethylmorpholin-4-yl)-1-(oxolan-3-yl)ethanol?
The IUPAC name of 2-(2,2-dimethylmorpholin-4-yl)-1-(oxolan-3-yl)ethanol (CID 104752564) is 2-(2,2-dimethylmorpholin-4-yl)-1-(oxolan-3-yl)ethanol.
What is the SMILES notation for 2-(2,2-dimethylmorpholin-4-yl)-1-(oxolan-3-yl)ethanol?
The canonical SMILES for 2-(2,2-dimethylmorpholin-4-yl)-1-(oxolan-3-yl)ethanol is CC1(C)CN(CC(O)C2CCOC2)CCO1.
What is the InChIKey of 2-(2,2-dimethylmorpholin-4-yl)-1-(oxolan-3-yl)ethanol?
The InChIKey is KDTDPQUIDKMCCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO3/c1-12(2)9-13(4-6-16-12)7-11(14)10-3-5-15-8-10/h10-11,14H,3-9H2,1-2H3.
What are the key properties of 2-(2,2-dimethylmorpholin-4-yl)-1-(oxolan-3-yl)ethanol?
2-(2,2-dimethylmorpholin-4-yl)-1-(oxolan-3-yl)ethanol has a molecular weight of 229.32 g/mol, XLogP of 0.49, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylmorpholin-4-yl)-1-(oxolan-3-yl)ethanol is sourced from PubChem (CID 104752564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).