1-(3,3-dimethylmorpholin-4-yl)-3-ethoxypropan-2-ol

C11H23NO3 — CID 63932943

IUPAC1-(3,3-dimethylmorpholin-4-yl)-3-ethoxypropan-2-ol
SMILESCCOCC(O)CN1CCOCC1(C)C
InChIInChI=1S/C11H23NO3/c1-4-14-8-10(13)7-12-5-6-15-9-11(12,2)3/h10,13H,4-9H2,1-3H3
InChIKeyMQGVKEBONAUZHJ-UHFFFAOYSA-N
MW217.31 g/mol
LogP0.49
Rot. Bonds5

About 1-(3,3-dimethylmorpholin-4-yl)-3-ethoxypropan-2-ol

1-(3,3-dimethylmorpholin-4-yl)-3-ethoxypropan-2-ol (PubChem CID 63932943) has the molecular formula C11H23NO3 and a molecular weight of 217.31 g/mol. Its IUPAC name is 1-(3,3-dimethylmorpholin-4-yl)-3-ethoxypropan-2-ol.

Molecular Properties

Compound Name1-(3,3-dimethylmorpholin-4-yl)-3-ethoxypropan-2-ol
PubChem CID63932943
Molecular FormulaC11H23NO3
Molecular Weight217.31 g/mol
Exact Mass217.17
IUPAC Name1-(3,3-dimethylmorpholin-4-yl)-3-ethoxypropan-2-ol
SMILESCCOCC(O)CN1CCOCC1(C)C
InChIInChI=1S/C11H23NO3/c1-4-14-8-10(13)7-12-5-6-15-9-11(12,2)3/h10,13H,4-9H2,1-3H3
InChIKeyMQGVKEBONAUZHJ-UHFFFAOYSA-N
XLogP0.49
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-1-(3,3-dimethylmorpholin-4-yl)propan-2-ol
CID 103935066
1-(3,3-dimethylmorpholin-4-yl)-3-(2-methylpropylamino)propan-2-ol
CID 113317478
1-[4-[3-(3,3-dimethylmorpholin-4-yl)-2-hydroxypropoxy]phenyl]ethanone
CID 47527320
3-(3,3-dimethylmorpholin-4-yl)-2-ethoxypropan-1-amine
CID 63070053
1-(4,4-dimethylpiperidin-1-yl)-3-ethoxypropan-2-ol
CID 63931924
1-(3,3-dimethylmorpholin-4-yl)-3-methoxypropan-2-amine
CID 81101994
1-(3,3-dimethylmorpholin-4-yl)-3-(2-prop-2-enylphenoxy)propan-2-ol
CID 138959729
1-(3,3-dimethylmorpholin-4-yl)-3-(3-methyl-4-propan-2-ylphenoxy)propan-2-ol;hydrochloride
CID 138959682
1-(3,3-dimethylmorpholin-4-yl)-N-methylbutan-2-amine
CID 62038435
(1S)-1-(4-bromophenyl)-2-(3,3-dimethylmorpholin-4-yl)ethanol
CID 92858364
3-(3,3-dimethylmorpholin-4-yl)-2-methylpropan-1-amine
CID 61430007
2-(3,3-dimethylmorpholin-4-yl)-N-(2-ethoxyethyl)ethanamine
CID 62558951

Frequently Asked Questions

What is the IUPAC name of 1-(3,3-dimethylmorpholin-4-yl)-3-ethoxypropan-2-ol?
The IUPAC name of 1-(3,3-dimethylmorpholin-4-yl)-3-ethoxypropan-2-ol (CID 63932943) is 1-(3,3-dimethylmorpholin-4-yl)-3-ethoxypropan-2-ol.
What is the SMILES notation for 1-(3,3-dimethylmorpholin-4-yl)-3-ethoxypropan-2-ol?
The canonical SMILES for 1-(3,3-dimethylmorpholin-4-yl)-3-ethoxypropan-2-ol is CCOCC(O)CN1CCOCC1(C)C.
What is the InChIKey of 1-(3,3-dimethylmorpholin-4-yl)-3-ethoxypropan-2-ol?
The InChIKey is MQGVKEBONAUZHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3/c1-4-14-8-10(13)7-12-5-6-15-9-11(12,2)3/h10,13H,4-9H2,1-3H3.
What are the key properties of 1-(3,3-dimethylmorpholin-4-yl)-3-ethoxypropan-2-ol?
1-(3,3-dimethylmorpholin-4-yl)-3-ethoxypropan-2-ol has a molecular weight of 217.31 g/mol, XLogP of 0.49, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,3-dimethylmorpholin-4-yl)-3-ethoxypropan-2-ol is sourced from PubChem (CID 63932943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).