2-ethoxy-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone

C12H18N4O2 — CID 60712299

IUPAC2-ethoxy-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone
SMILESCCOCC(=O)N1CCN(c2cnccn2)CC1
InChIInChI=1S/C12H18N4O2/c1-2-18-10-12(17)16-7-5-15(6-8-16)11-9-13-3-4-14-11/h3-4,9H,2,5-8,10H2,1H3
InChIKeyLDDXQTRNLKCJDF-UHFFFAOYSA-N
MW250.30 g/mol
LogP0.16
Rot. Bonds4

About 2-ethoxy-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone

2-ethoxy-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone (PubChem CID 60712299) has the molecular formula C12H18N4O2 and a molecular weight of 250.30 g/mol. Its IUPAC name is 2-ethoxy-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone.

Molecular Properties

Compound Name2-ethoxy-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone
PubChem CID60712299
Molecular FormulaC12H18N4O2
Molecular Weight250.30 g/mol
Exact Mass250.14
IUPAC Name2-ethoxy-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone
SMILESCCOCC(=O)N1CCN(c2cnccn2)CC1
InChIInChI=1S/C12H18N4O2/c1-2-18-10-12(17)16-7-5-15(6-8-16)11-9-13-3-4-14-11/h3-4,9H,2,5-8,10H2,1H3
InChIKeyLDDXQTRNLKCJDF-UHFFFAOYSA-N
XLogP0.16
TPSA58.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 50.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-ethoxy-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(4-pyrazin-2-ylpiperazin-1-yl)propan-1-one
CID 60715497
1-(4-pyrazin-2-ylpiperazin-1-yl)pentan-1-one
CID 143717135
2-(4-methoxyphenyl)-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone
CID 42023151
2-ethoxy-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]ethanone
CID 60708282
(2S)-2-amino-1-(4-pyrazin-2-ylpiperazin-1-yl)butan-1-one
CID 79024559
2-(4-bromo-2-fluorophenoxy)-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone
CID 17498992
2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone
CID 18270392
2-(1,1-dioxo-1,4-thiazinan-4-yl)-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone
CID 56796063
2-(aminomethyl)-1-(4-pyrazin-2-ylpiperazin-1-yl)butan-1-one
CID 65227346
2-(3-amino-1,2,4-triazol-1-yl)-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone
CID 61107847
(2R)-2-chloro-1-(4-pyrazin-2-ylpiperazin-1-yl)propan-1-one
CID 93378573
2-[(5-phenyl-1,3,4-oxadiazol-2-yl)oxy]-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone
CID 126767174

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone?
The IUPAC name of 2-ethoxy-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone (CID 60712299) is 2-ethoxy-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone.
What is the SMILES notation for 2-ethoxy-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone?
The canonical SMILES for 2-ethoxy-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone is CCOCC(=O)N1CCN(c2cnccn2)CC1.
What is the InChIKey of 2-ethoxy-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone?
The InChIKey is LDDXQTRNLKCJDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O2/c1-2-18-10-12(17)16-7-5-15(6-8-16)11-9-13-3-4-14-11/h3-4,9H,2,5-8,10H2,1H3.
What are the key properties of 2-ethoxy-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone?
2-ethoxy-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone has a molecular weight of 250.30 g/mol, XLogP of 0.16, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone is sourced from PubChem (CID 60712299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).