2-cyclohexyloxy-3-(4-methylpiperazin-1-yl)quinoxaline

C19H26N4O — CID 24853662

IUPAC2-cyclohexyloxy-3-(4-methylpiperazin-1-yl)quinoxaline
SMILESCN1CCN(c2nc3ccccc3nc2OC2CCCCC2)CC1
InChIInChI=1S/C19H26N4O/c1-22-11-13-23(14-12-22)18-19(24-15-7-3-2-4-8-15)21-17-10-6-5-9-16(17)20-18/h5-6,9-10,15H,2-4,7-8,11-14H2,1H3
InChIKeyGIXMGAZXZYZEJB-UHFFFAOYSA-N
MW326.44 g/mol
LogP3.09
Rot. Bonds3

About 2-cyclohexyloxy-3-(4-methylpiperazin-1-yl)quinoxaline

2-cyclohexyloxy-3-(4-methylpiperazin-1-yl)quinoxaline (PubChem CID 24853662) has the molecular formula C19H26N4O and a molecular weight of 326.44 g/mol. Its IUPAC name is 2-cyclohexyloxy-3-(4-methylpiperazin-1-yl)quinoxaline.

Molecular Properties

Compound Name2-cyclohexyloxy-3-(4-methylpiperazin-1-yl)quinoxaline
PubChem CID24853662
Molecular FormulaC19H26N4O
Molecular Weight326.44 g/mol
Exact Mass326.21
IUPAC Name2-cyclohexyloxy-3-(4-methylpiperazin-1-yl)quinoxaline
SMILESCN1CCN(c2nc3ccccc3nc2OC2CCCCC2)CC1
InChIInChI=1S/C19H26N4O/c1-22-11-13-23(14-12-22)18-19(24-15-7-3-2-4-8-15)21-17-10-6-5-9-16(17)20-18/h5-6,9-10,15H,2-4,7-8,11-14H2,1H3
InChIKeyGIXMGAZXZYZEJB-UHFFFAOYSA-N
XLogP3.09
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyloxy-3-(4-methylpiperazin-1-yl)quinoxaline?
The IUPAC name of 2-cyclohexyloxy-3-(4-methylpiperazin-1-yl)quinoxaline (CID 24853662) is 2-cyclohexyloxy-3-(4-methylpiperazin-1-yl)quinoxaline.
What is the SMILES notation for 2-cyclohexyloxy-3-(4-methylpiperazin-1-yl)quinoxaline?
The canonical SMILES for 2-cyclohexyloxy-3-(4-methylpiperazin-1-yl)quinoxaline is CN1CCN(c2nc3ccccc3nc2OC2CCCCC2)CC1.
What is the InChIKey of 2-cyclohexyloxy-3-(4-methylpiperazin-1-yl)quinoxaline?
The InChIKey is GIXMGAZXZYZEJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O/c1-22-11-13-23(14-12-22)18-19(24-15-7-3-2-4-8-15)21-17-10-6-5-9-16(17)20-18/h5-6,9-10,15H,2-4,7-8,11-14H2,1H3.
What are the key properties of 2-cyclohexyloxy-3-(4-methylpiperazin-1-yl)quinoxaline?
2-cyclohexyloxy-3-(4-methylpiperazin-1-yl)quinoxaline has a molecular weight of 326.44 g/mol, XLogP of 3.09, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyloxy-3-(4-methylpiperazin-1-yl)quinoxaline is sourced from PubChem (CID 24853662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).