2-[(3R)-3-ethylpiperazin-1-yl]quinoxaline

C14H18N4 — CID 129409830

IUPAC2-[(3R)-3-ethylpiperazin-1-yl]quinoxaline
SMILESCC[C@@H]1CN(c2cnc3ccccc3n2)CCN1
InChIInChI=1S/C14H18N4/c1-2-11-10-18(8-7-15-11)14-9-16-12-5-3-4-6-13(12)17-14/h3-6,9,11,15H,2,7-8,10H2,1H3/t11-/m1/s1
InChIKeyJQFKZJCDWTUKFE-LLVKDONJSA-N
MW242.33 g/mol
LogP1.82
Rot. Bonds2

About 2-[(3R)-3-ethylpiperazin-1-yl]quinoxaline

2-[(3R)-3-ethylpiperazin-1-yl]quinoxaline (PubChem CID 129409830) has the molecular formula C14H18N4 and a molecular weight of 242.33 g/mol. Its IUPAC name is 2-[(3R)-3-ethylpiperazin-1-yl]quinoxaline.

Molecular Properties

Compound Name2-[(3R)-3-ethylpiperazin-1-yl]quinoxaline
PubChem CID129409830
Molecular FormulaC14H18N4
Molecular Weight242.33 g/mol
Exact Mass242.15
IUPAC Name2-[(3R)-3-ethylpiperazin-1-yl]quinoxaline
SMILESCC[C@@H]1CN(c2cnc3ccccc3n2)CCN1
InChIInChI=1S/C14H18N4/c1-2-11-10-18(8-7-15-11)14-9-16-12-5-3-4-6-13(12)17-14/h3-6,9,11,15H,2,7-8,10H2,1H3/t11-/m1/s1
InChIKeyJQFKZJCDWTUKFE-LLVKDONJSA-N
XLogP1.82
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.33
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-3-ethylpiperazin-1-yl]quinoxaline?
The IUPAC name of 2-[(3R)-3-ethylpiperazin-1-yl]quinoxaline (CID 129409830) is 2-[(3R)-3-ethylpiperazin-1-yl]quinoxaline.
What is the SMILES notation for 2-[(3R)-3-ethylpiperazin-1-yl]quinoxaline?
The canonical SMILES for 2-[(3R)-3-ethylpiperazin-1-yl]quinoxaline is CC[C@@H]1CN(c2cnc3ccccc3n2)CCN1.
What is the InChIKey of 2-[(3R)-3-ethylpiperazin-1-yl]quinoxaline?
The InChIKey is JQFKZJCDWTUKFE-LLVKDONJSA-N. The full InChI is InChI=1S/C14H18N4/c1-2-11-10-18(8-7-15-11)14-9-16-12-5-3-4-6-13(12)17-14/h3-6,9,11,15H,2,7-8,10H2,1H3/t11-/m1/s1.
What are the key properties of 2-[(3R)-3-ethylpiperazin-1-yl]quinoxaline?
2-[(3R)-3-ethylpiperazin-1-yl]quinoxaline has a molecular weight of 242.33 g/mol, XLogP of 1.82, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-3-ethylpiperazin-1-yl]quinoxaline is sourced from PubChem (CID 129409830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).