2-(4-benzylpiperazin-1-yl)quinoxaline

C19H20N4 — CID 4551756

IUPAC2-(4-benzylpiperazin-1-yl)quinoxaline
SMILESc1ccc(CN2CCN(c3cnc4ccccc4n3)CC2)cc1
InChIInChI=1S/C19H20N4/c1-2-6-16(7-3-1)15-22-10-12-23(13-11-22)19-14-20-17-8-4-5-9-18(17)21-19/h1-9,14H,10-13,15H2
InChIKeyLSZXKRKXWSDWJY-UHFFFAOYSA-N
MW304.40 g/mol
LogP2.95
Rot. Bonds3

About 2-(4-benzylpiperazin-1-yl)quinoxaline

2-(4-benzylpiperazin-1-yl)quinoxaline (PubChem CID 4551756) has the molecular formula C19H20N4 and a molecular weight of 304.40 g/mol. Its IUPAC name is 2-(4-benzylpiperazin-1-yl)quinoxaline.

Molecular Properties

Compound Name2-(4-benzylpiperazin-1-yl)quinoxaline
PubChem CID4551756
Molecular FormulaC19H20N4
Molecular Weight304.40 g/mol
Exact Mass304.17
IUPAC Name2-(4-benzylpiperazin-1-yl)quinoxaline
SMILESc1ccc(CN2CCN(c3cnc4ccccc4n3)CC2)cc1
InChIInChI=1S/C19H20N4/c1-2-6-16(7-3-1)15-22-10-12-23(13-11-22)19-14-20-17-8-4-5-9-18(17)21-19/h1-9,14H,10-13,15H2
InChIKeyLSZXKRKXWSDWJY-UHFFFAOYSA-N
XLogP2.95
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.40
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-benzylpiperazin-1-yl)quinoxaline?
The IUPAC name of 2-(4-benzylpiperazin-1-yl)quinoxaline (CID 4551756) is 2-(4-benzylpiperazin-1-yl)quinoxaline.
What is the SMILES notation for 2-(4-benzylpiperazin-1-yl)quinoxaline?
The canonical SMILES for 2-(4-benzylpiperazin-1-yl)quinoxaline is c1ccc(CN2CCN(c3cnc4ccccc4n3)CC2)cc1.
What is the InChIKey of 2-(4-benzylpiperazin-1-yl)quinoxaline?
The InChIKey is LSZXKRKXWSDWJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4/c1-2-6-16(7-3-1)15-22-10-12-23(13-11-22)19-14-20-17-8-4-5-9-18(17)21-19/h1-9,14H,10-13,15H2.
What are the key properties of 2-(4-benzylpiperazin-1-yl)quinoxaline?
2-(4-benzylpiperazin-1-yl)quinoxaline has a molecular weight of 304.40 g/mol, XLogP of 2.95, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-benzylpiperazin-1-yl)quinoxaline is sourced from PubChem (CID 4551756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).