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

C15H27N3O2 — CID 84590372

IUPAC1-(2,6-dimethylmorpholin-4-yl)-3-(2-propan-2-ylimidazol-1-yl)propan-2-ol
SMILESCC1CN(CC(O)Cn2ccnc2C(C)C)CC(C)O1
InChIInChI=1S/C15H27N3O2/c1-11(2)15-16-5-6-18(15)10-14(19)9-17-7-12(3)20-13(4)8-17/h5-6,11-14,19H,7-10H2,1-4H3
InChIKeyOQPUCFZDIPNVQJ-UHFFFAOYSA-N
MW281.40 g/mol
LogP1.48
Rot. Bonds5

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

1-(2,6-dimethylmorpholin-4-yl)-3-(2-propan-2-ylimidazol-1-yl)propan-2-ol (PubChem CID 84590372) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is 1-(2,6-dimethylmorpholin-4-yl)-3-(2-propan-2-ylimidazol-1-yl)propan-2-ol.

Molecular Properties

Compound Name1-(2,6-dimethylmorpholin-4-yl)-3-(2-propan-2-ylimidazol-1-yl)propan-2-ol
PubChem CID84590372
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC Name1-(2,6-dimethylmorpholin-4-yl)-3-(2-propan-2-ylimidazol-1-yl)propan-2-ol
SMILESCC1CN(CC(O)Cn2ccnc2C(C)C)CC(C)O1
InChIInChI=1S/C15H27N3O2/c1-11(2)15-16-5-6-18(15)10-14(19)9-17-7-12(3)20-13(4)8-17/h5-6,11-14,19H,7-10H2,1-4H3
InChIKeyOQPUCFZDIPNVQJ-UHFFFAOYSA-N
XLogP1.48
TPSA50.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dimethylmorpholin-4-yl)-3-(2-propan-2-ylimidazol-1-yl)propan-2-ol?
The IUPAC name of 1-(2,6-dimethylmorpholin-4-yl)-3-(2-propan-2-ylimidazol-1-yl)propan-2-ol (CID 84590372) is 1-(2,6-dimethylmorpholin-4-yl)-3-(2-propan-2-ylimidazol-1-yl)propan-2-ol.
What is the SMILES notation for 1-(2,6-dimethylmorpholin-4-yl)-3-(2-propan-2-ylimidazol-1-yl)propan-2-ol?
The canonical SMILES for 1-(2,6-dimethylmorpholin-4-yl)-3-(2-propan-2-ylimidazol-1-yl)propan-2-ol is CC1CN(CC(O)Cn2ccnc2C(C)C)CC(C)O1.
What is the InChIKey of 1-(2,6-dimethylmorpholin-4-yl)-3-(2-propan-2-ylimidazol-1-yl)propan-2-ol?
The InChIKey is OQPUCFZDIPNVQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c1-11(2)15-16-5-6-18(15)10-14(19)9-17-7-12(3)20-13(4)8-17/h5-6,11-14,19H,7-10H2,1-4H3.
What are the key properties of 1-(2,6-dimethylmorpholin-4-yl)-3-(2-propan-2-ylimidazol-1-yl)propan-2-ol?
1-(2,6-dimethylmorpholin-4-yl)-3-(2-propan-2-ylimidazol-1-yl)propan-2-ol has a molecular weight of 281.40 g/mol, XLogP of 1.48, 5 rotatable bonds, 1 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-propan-2-ylimidazol-1-yl)propan-2-ol is sourced from PubChem (CID 84590372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).