3-(2,2,6,6-tetramethylmorpholin-4-yl)oxan-4-ol

C13H25NO3 — CID 102745369

IUPAC3-(2,2,6,6-tetramethylmorpholin-4-yl)oxan-4-ol
SMILESCC1(C)CN(C2COCCC2O)CC(C)(C)O1
InChIInChI=1S/C13H25NO3/c1-12(2)8-14(9-13(3,4)17-12)10-7-16-6-5-11(10)15/h10-11,15H,5-9H2,1-4H3
InChIKeyBKVUVGRPSUQSAW-UHFFFAOYSA-N
MW243.35 g/mol
LogP1.03
Rot. Bonds1

About 3-(2,2,6,6-tetramethylmorpholin-4-yl)oxan-4-ol

3-(2,2,6,6-tetramethylmorpholin-4-yl)oxan-4-ol (PubChem CID 102745369) has the molecular formula C13H25NO3 and a molecular weight of 243.35 g/mol. Its IUPAC name is 3-(2,2,6,6-tetramethylmorpholin-4-yl)oxan-4-ol.

Molecular Properties

Compound Name3-(2,2,6,6-tetramethylmorpholin-4-yl)oxan-4-ol
PubChem CID102745369
Molecular FormulaC13H25NO3
Molecular Weight243.35 g/mol
Exact Mass243.18
IUPAC Name3-(2,2,6,6-tetramethylmorpholin-4-yl)oxan-4-ol
SMILESCC1(C)CN(C2COCCC2O)CC(C)(C)O1
InChIInChI=1S/C13H25NO3/c1-12(2)8-14(9-13(3,4)17-12)10-7-16-6-5-11(10)15/h10-11,15H,5-9H2,1-4H3
InChIKeyBKVUVGRPSUQSAW-UHFFFAOYSA-N
XLogP1.03
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)oxan-4-ol
CID 115763463
1-(oxolan-3-yl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanol
CID 102745374
3-(3-methoxypyrrolidin-1-yl)oxan-4-ol
CID 103537640
3-(4-ethyl-3-methylpiperazin-1-yl)oxan-4-ol
CID 63635222
2-(2,2,6,6-tetramethylmorpholin-4-yl)cycloheptane-1-carboxylic acid
CID 102746280
8-[(3S,4S)-4-hydroxyoxan-3-yl]-1,3,8-triazaspiro[4.5]decan-4-one
CID 69486464
1-(2-hydroxycyclobutyl)-3-methylazetidin-3-ol
CID 126856761
(3S,4S)-3-(3,6-dichlorocarbazol-9-yl)oxan-4-ol
CID 155083992
1-cyclopropyl-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanol
CID 102745370
1-[(1S,2S)-2-hydroxycyclopentyl]-3-methylazetidin-3-ol
CID 131182347
3-(methylamino)oxan-4-ol
CID 55287171
3-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)oxan-4-ol
CID 131048816

Frequently Asked Questions

What is the IUPAC name of 3-(2,2,6,6-tetramethylmorpholin-4-yl)oxan-4-ol?
The IUPAC name of 3-(2,2,6,6-tetramethylmorpholin-4-yl)oxan-4-ol (CID 102745369) is 3-(2,2,6,6-tetramethylmorpholin-4-yl)oxan-4-ol.
What is the SMILES notation for 3-(2,2,6,6-tetramethylmorpholin-4-yl)oxan-4-ol?
The canonical SMILES for 3-(2,2,6,6-tetramethylmorpholin-4-yl)oxan-4-ol is CC1(C)CN(C2COCCC2O)CC(C)(C)O1.
What is the InChIKey of 3-(2,2,6,6-tetramethylmorpholin-4-yl)oxan-4-ol?
The InChIKey is BKVUVGRPSUQSAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO3/c1-12(2)8-14(9-13(3,4)17-12)10-7-16-6-5-11(10)15/h10-11,15H,5-9H2,1-4H3.
What are the key properties of 3-(2,2,6,6-tetramethylmorpholin-4-yl)oxan-4-ol?
3-(2,2,6,6-tetramethylmorpholin-4-yl)oxan-4-ol has a molecular weight of 243.35 g/mol, XLogP of 1.03, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,2,6,6-tetramethylmorpholin-4-yl)oxan-4-ol is sourced from PubChem (CID 102745369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).