2-ethoxy-1-(4-ethylpiperazin-1-yl)ethanone

C10H20N2O2 — CID 2947957

IUPAC2-ethoxy-1-(4-ethylpiperazin-1-yl)ethanone
SMILESCCOCC(=O)N1CCN(CC)CC1
InChIInChI=1S/C10H20N2O2/c1-3-11-5-7-12(8-6-11)10(13)9-14-4-2/h3-9H2,1-2H3
InChIKeyKTOWUJAJQNOXPB-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.19
Rot. Bonds4

About 2-ethoxy-1-(4-ethylpiperazin-1-yl)ethanone

2-ethoxy-1-(4-ethylpiperazin-1-yl)ethanone (PubChem CID 2947957) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 2-ethoxy-1-(4-ethylpiperazin-1-yl)ethanone.

Molecular Properties

Compound Name2-ethoxy-1-(4-ethylpiperazin-1-yl)ethanone
PubChem CID2947957
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name2-ethoxy-1-(4-ethylpiperazin-1-yl)ethanone
SMILESCCOCC(=O)N1CCN(CC)CC1
InChIInChI=1S/C10H20N2O2/c1-3-11-5-7-12(8-6-11)10(13)9-14-4-2/h3-9H2,1-2H3
InChIKeyKTOWUJAJQNOXPB-UHFFFAOYSA-N
XLogP0.19
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 204973
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CID 204974
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CID 205041
CID 205041
CID 12729092
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CID 770040
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CID 532078
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CID 204975
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CID 204976
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CID 13715574
CID 13715574
CID 2166906
CID 2166906

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1-(4-ethylpiperazin-1-yl)ethanone?
The IUPAC name of 2-ethoxy-1-(4-ethylpiperazin-1-yl)ethanone (CID 2947957) is 2-ethoxy-1-(4-ethylpiperazin-1-yl)ethanone.
What is the SMILES notation for 2-ethoxy-1-(4-ethylpiperazin-1-yl)ethanone?
The canonical SMILES for 2-ethoxy-1-(4-ethylpiperazin-1-yl)ethanone is CCOCC(=O)N1CCN(CC)CC1.
What is the InChIKey of 2-ethoxy-1-(4-ethylpiperazin-1-yl)ethanone?
The InChIKey is KTOWUJAJQNOXPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-3-11-5-7-12(8-6-11)10(13)9-14-4-2/h3-9H2,1-2H3.
What are the key properties of 2-ethoxy-1-(4-ethylpiperazin-1-yl)ethanone?
2-ethoxy-1-(4-ethylpiperazin-1-yl)ethanone has a molecular weight of 200.28 g/mol, XLogP of 0.19, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1-(4-ethylpiperazin-1-yl)ethanone is sourced from PubChem (CID 2947957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).