1-(2-ethylmorpholin-4-yl)-2-piperazin-1-ylethanone

C12H23N3O2 — CID 43563037

IUPAC1-(2-ethylmorpholin-4-yl)-2-piperazin-1-ylethanone
SMILESCCC1CN(C(=O)CN2CCNCC2)CCO1
InChIInChI=1S/C12H23N3O2/c1-2-11-9-15(7-8-17-11)12(16)10-14-5-3-13-4-6-14/h11,13H,2-10H2,1H3
InChIKeyZPDOGXJKGAAOQD-UHFFFAOYSA-N
MW241.33 g/mol
LogP-0.47
Rot. Bonds3

About 1-(2-ethylmorpholin-4-yl)-2-piperazin-1-ylethanone

1-(2-ethylmorpholin-4-yl)-2-piperazin-1-ylethanone (PubChem CID 43563037) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is 1-(2-ethylmorpholin-4-yl)-2-piperazin-1-ylethanone.

Molecular Properties

Compound Name1-(2-ethylmorpholin-4-yl)-2-piperazin-1-ylethanone
PubChem CID43563037
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name1-(2-ethylmorpholin-4-yl)-2-piperazin-1-ylethanone
SMILESCCC1CN(C(=O)CN2CCNCC2)CCO1
InChIInChI=1S/C12H23N3O2/c1-2-11-9-15(7-8-17-11)12(16)10-14-5-3-13-4-6-14/h11,13H,2-10H2,1H3
InChIKeyZPDOGXJKGAAOQD-UHFFFAOYSA-N
XLogP-0.47
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 5-0.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2S)-2-[(dimethylamino)methyl]morpholin-4-yl]-1-[(2R)-2-ethylmorpholin-4-yl]ethanone
CID 100843897
1-(2-ethylmorpholin-4-yl)-2-morpholin-2-ylethanone
CID 66432993
(2-ethylmorpholin-4-yl)-(4-ethylpiperidin-4-yl)methanone
CID 63128124
2-ethylmorpholine-4-carboxylic acid
CID 121455686
2-[4-[2-[(2R)-2-ethylmorpholin-4-yl]-2-oxoethyl]piperazin-1-yl]pyridine-4-carbonitrile
CID 95586051
3-(4-aminocyclohexyl)-1-(2-ethylmorpholin-4-yl)propan-1-one
CID 55116609
(2-ethylmorpholin-4-yl)-(3-methylpyrrolidin-3-yl)methanone
CID 63138991
2-[2-(2-methoxyethyl)morpholin-4-yl]-1-piperazin-1-ylethanone
CID 131914885
1-ethyl-3-[2-(2-ethylmorpholin-4-yl)-2-oxoethyl]benzimidazol-2-one
CID 43070571
1-[(2R)-2-ethylmorpholin-4-yl]-2,2-dimethylpropan-1-one
CID 166684101
(1-aminocyclopropyl)-(2-ethylmorpholin-4-yl)methanone
CID 65466783
1-[3-(dimethylamino)pyrrolidin-1-yl]-2-piperazin-1-ylethanone
CID 55169216

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylmorpholin-4-yl)-2-piperazin-1-ylethanone?
The IUPAC name of 1-(2-ethylmorpholin-4-yl)-2-piperazin-1-ylethanone (CID 43563037) is 1-(2-ethylmorpholin-4-yl)-2-piperazin-1-ylethanone.
What is the SMILES notation for 1-(2-ethylmorpholin-4-yl)-2-piperazin-1-ylethanone?
The canonical SMILES for 1-(2-ethylmorpholin-4-yl)-2-piperazin-1-ylethanone is CCC1CN(C(=O)CN2CCNCC2)CCO1.
What is the InChIKey of 1-(2-ethylmorpholin-4-yl)-2-piperazin-1-ylethanone?
The InChIKey is ZPDOGXJKGAAOQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-2-11-9-15(7-8-17-11)12(16)10-14-5-3-13-4-6-14/h11,13H,2-10H2,1H3.
What are the key properties of 1-(2-ethylmorpholin-4-yl)-2-piperazin-1-ylethanone?
1-(2-ethylmorpholin-4-yl)-2-piperazin-1-ylethanone has a molecular weight of 241.33 g/mol, XLogP of -0.47, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylmorpholin-4-yl)-2-piperazin-1-ylethanone is sourced from PubChem (CID 43563037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).