2-(2-ethylimidazol-1-yl)-1-(3-propylmorpholin-4-yl)ethanone

C14H23N3O2 — CID 56869890

IUPAC2-(2-ethylimidazol-1-yl)-1-(3-propylmorpholin-4-yl)ethanone
SMILESCCCC1COCCN1C(=O)Cn1ccnc1CC
InChIInChI=1S/C14H23N3O2/c1-3-5-12-11-19-9-8-17(12)14(18)10-16-7-6-15-13(16)4-2/h6-7,12H,3-5,8-11H2,1-2H3
InChIKeyQEOVYFVUWVKOHV-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.47
Rot. Bonds5

About 2-(2-ethylimidazol-1-yl)-1-(3-propylmorpholin-4-yl)ethanone

2-(2-ethylimidazol-1-yl)-1-(3-propylmorpholin-4-yl)ethanone (PubChem CID 56869890) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-(2-ethylimidazol-1-yl)-1-(3-propylmorpholin-4-yl)ethanone.

Molecular Properties

Compound Name2-(2-ethylimidazol-1-yl)-1-(3-propylmorpholin-4-yl)ethanone
PubChem CID56869890
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name2-(2-ethylimidazol-1-yl)-1-(3-propylmorpholin-4-yl)ethanone
SMILESCCCC1COCCN1C(=O)Cn1ccnc1CC
InChIInChI=1S/C14H23N3O2/c1-3-5-12-11-19-9-8-17(12)14(18)10-16-7-6-15-13(16)4-2/h6-7,12H,3-5,8-11H2,1-2H3
InChIKeyQEOVYFVUWVKOHV-UHFFFAOYSA-N
XLogP1.47
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[3-(2-ethyl-1H-imidazol-1-yl)piperidin-1-yl]-3-(2,2,2-trifluoroethoxy)propan-1-one
CID 53623121
2-[4-[(1-Methylimidazol-2-yl)methyl]piperazin-1-yl]-1-morpholin-4-ylpropan-1-one
CID 53559966
2-[4-[(1-ethylimidazol-2-yl)methyl]piperazin-1-yl]-N-(oxan-4-yl)acetamide
CID 53561047
2-[3-Methyl-4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]-1-morpholin-4-ylethanone
CID 53570699
2-[3-methyl-4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]-N-(oxan-4-yl)acetamide
CID 53571257
2-Cyclohexyloxy-1-(3-imidazol-1-ylpiperidin-1-yl)ethanone
CID 53595554
2-(Cyclopropylmethoxy)-1-[3-(2-methylimidazol-1-yl)piperidin-1-yl]ethanone
CID 53603961
2-(Cyclopropylmethoxy)-1-(3-imidazol-1-ylpiperidin-1-yl)ethanone
CID 53604957
2-Cyclopentyloxy-1-[3-(2-methylimidazol-1-yl)piperidin-1-yl]ethanone
CID 53606966
1-(3-Imidazol-1-ylpiperidin-1-yl)-2-[methyl(propan-2-yl)amino]ethanone
CID 53617604
1-[3-(2-Methylimidazol-1-yl)piperidin-1-yl]-3-(2,2,2-trifluoroethoxy)propan-1-one
CID 53618996
1-[3-(2-Methylimidazol-1-yl)piperidin-1-yl]-2-(2,2,2-trifluoroethoxy)ethanone
CID 53620398

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylimidazol-1-yl)-1-(3-propylmorpholin-4-yl)ethanone?
The IUPAC name of 2-(2-ethylimidazol-1-yl)-1-(3-propylmorpholin-4-yl)ethanone (CID 56869890) is 2-(2-ethylimidazol-1-yl)-1-(3-propylmorpholin-4-yl)ethanone.
What is the SMILES notation for 2-(2-ethylimidazol-1-yl)-1-(3-propylmorpholin-4-yl)ethanone?
The canonical SMILES for 2-(2-ethylimidazol-1-yl)-1-(3-propylmorpholin-4-yl)ethanone is CCCC1COCCN1C(=O)Cn1ccnc1CC.
What is the InChIKey of 2-(2-ethylimidazol-1-yl)-1-(3-propylmorpholin-4-yl)ethanone?
The InChIKey is QEOVYFVUWVKOHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-3-5-12-11-19-9-8-17(12)14(18)10-16-7-6-15-13(16)4-2/h6-7,12H,3-5,8-11H2,1-2H3.
What are the key properties of 2-(2-ethylimidazol-1-yl)-1-(3-propylmorpholin-4-yl)ethanone?
2-(2-ethylimidazol-1-yl)-1-(3-propylmorpholin-4-yl)ethanone has a molecular weight of 265.36 g/mol, XLogP of 1.47, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylimidazol-1-yl)-1-(3-propylmorpholin-4-yl)ethanone is sourced from PubChem (CID 56869890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).