1-(2,6-dimethylmorpholin-4-yl)-3-(2-methoxyethylamino)propan-2-ol

C12H26N2O3 — CID 78971493

IUPAC1-(2,6-dimethylmorpholin-4-yl)-3-(2-methoxyethylamino)propan-2-ol
SMILESCOCCNCC(O)CN1CC(C)OC(C)C1
InChIInChI=1S/C12H26N2O3/c1-10-7-14(8-11(2)17-10)9-12(15)6-13-4-5-16-3/h10-13,15H,4-9H2,1-3H3
InChIKeyFIHQOSZHXFTINA-UHFFFAOYSA-N
MW246.35 g/mol
LogP-0.31
Rot. Bonds7

About 1-(2,6-dimethylmorpholin-4-yl)-3-(2-methoxyethylamino)propan-2-ol

1-(2,6-dimethylmorpholin-4-yl)-3-(2-methoxyethylamino)propan-2-ol (PubChem CID 78971493) has the molecular formula C12H26N2O3 and a molecular weight of 246.35 g/mol. Its IUPAC name is 1-(2,6-dimethylmorpholin-4-yl)-3-(2-methoxyethylamino)propan-2-ol.

Molecular Properties

Compound Name1-(2,6-dimethylmorpholin-4-yl)-3-(2-methoxyethylamino)propan-2-ol
PubChem CID78971493
Molecular FormulaC12H26N2O3
Molecular Weight246.35 g/mol
Exact Mass246.19
IUPAC Name1-(2,6-dimethylmorpholin-4-yl)-3-(2-methoxyethylamino)propan-2-ol
SMILESCOCCNCC(O)CN1CC(C)OC(C)C1
InChIInChI=1S/C12H26N2O3/c1-10-7-14(8-11(2)17-10)9-12(15)6-13-4-5-16-3/h10-13,15H,4-9H2,1-3H3
InChIKeyFIHQOSZHXFTINA-UHFFFAOYSA-N
XLogP-0.31
TPSA53.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 5-0.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(3,4-dimethylpyrrolidin-1-yl)-3-(2-methoxyethylamino)propan-2-ol
CID 115475430
1,3-bis(2,6-dimethylmorpholin-4-yl)propan-2-ol
CID 70522448
(2S)-1-(cyclopropylamino)-3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propan-2-ol
CID 124550922
1-(2-methoxyethylamino)-3-(4-propylpiperazin-1-yl)propan-2-ol
CID 113317417
1-(2,6-dimethylmorpholin-4-yl)-3-(2,4,4-trimethylpentan-2-ylamino)propan-2-ol
CID 110905093
1-(4-cyclopentylpiperazin-1-yl)-3-(2-methoxyethylamino)propan-2-ol
CID 115475228
1-(2,2-dimethylmorpholin-4-yl)-3-(2-methoxyethylamino)propan-2-ol
CID 113317455
1-bromo-3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propan-2-ol
CID 104959987
1-(2-methoxyethylamino)-3-(3-phenylpyrrolidin-1-yl)propan-2-ol
CID 115475222
1-(2-methoxyethylamino)-3-(1-methyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-6-yl)propan-2-ol
CID 115475490
1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-methoxybutan-2-amine
CID 104959201
4-[2-hydroxy-3-(2-methoxyethylamino)propyl]morpholine-3,5-dione
CID 115475673

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dimethylmorpholin-4-yl)-3-(2-methoxyethylamino)propan-2-ol?
The IUPAC name of 1-(2,6-dimethylmorpholin-4-yl)-3-(2-methoxyethylamino)propan-2-ol (CID 78971493) is 1-(2,6-dimethylmorpholin-4-yl)-3-(2-methoxyethylamino)propan-2-ol.
What is the SMILES notation for 1-(2,6-dimethylmorpholin-4-yl)-3-(2-methoxyethylamino)propan-2-ol?
The canonical SMILES for 1-(2,6-dimethylmorpholin-4-yl)-3-(2-methoxyethylamino)propan-2-ol is COCCNCC(O)CN1CC(C)OC(C)C1.
What is the InChIKey of 1-(2,6-dimethylmorpholin-4-yl)-3-(2-methoxyethylamino)propan-2-ol?
The InChIKey is FIHQOSZHXFTINA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O3/c1-10-7-14(8-11(2)17-10)9-12(15)6-13-4-5-16-3/h10-13,15H,4-9H2,1-3H3.
What are the key properties of 1-(2,6-dimethylmorpholin-4-yl)-3-(2-methoxyethylamino)propan-2-ol?
1-(2,6-dimethylmorpholin-4-yl)-3-(2-methoxyethylamino)propan-2-ol has a molecular weight of 246.35 g/mol, XLogP of -0.31, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dimethylmorpholin-4-yl)-3-(2-methoxyethylamino)propan-2-ol is sourced from PubChem (CID 78971493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).