2-(4-methylpiperazin-1-yl)-3-phenylmethoxyquinoxaline

C20H22N4O — CID 24854638

IUPAC2-(4-methylpiperazin-1-yl)-3-phenylmethoxyquinoxaline
SMILESCN1CCN(c2nc3ccccc3nc2OCc2ccccc2)CC1
InChIInChI=1S/C20H22N4O/c1-23-11-13-24(14-12-23)19-20(25-15-16-7-3-2-4-8-16)22-18-10-6-5-9-17(18)21-19/h2-10H,11-15H2,1H3
InChIKeyWQPDXBDZVNUMOW-UHFFFAOYSA-N
MW334.42 g/mol
LogP2.96
Rot. Bonds4

About 2-(4-methylpiperazin-1-yl)-3-phenylmethoxyquinoxaline

2-(4-methylpiperazin-1-yl)-3-phenylmethoxyquinoxaline (PubChem CID 24854638) has the molecular formula C20H22N4O and a molecular weight of 334.42 g/mol. Its IUPAC name is 2-(4-methylpiperazin-1-yl)-3-phenylmethoxyquinoxaline.

Molecular Properties

Compound Name2-(4-methylpiperazin-1-yl)-3-phenylmethoxyquinoxaline
PubChem CID24854638
Molecular FormulaC20H22N4O
Molecular Weight334.42 g/mol
Exact Mass334.18
IUPAC Name2-(4-methylpiperazin-1-yl)-3-phenylmethoxyquinoxaline
SMILESCN1CCN(c2nc3ccccc3nc2OCc2ccccc2)CC1
InChIInChI=1S/C20H22N4O/c1-23-11-13-24(14-12-23)19-20(25-15-16-7-3-2-4-8-16)22-18-10-6-5-9-17(18)21-19/h2-10H,11-15H2,1H3
InChIKeyWQPDXBDZVNUMOW-UHFFFAOYSA-N
XLogP2.96
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1,2,3,4,4a,5-Hexahydropyrido[1',2':4,5][1,4]oxazino[2,3-b]quinoxaline
CID 4438134
2-Methyl-3-((6-(pyrrolidin-1-yl)pyridin-2-yl)methoxy)quinoxaline
CID 72706474
2-Ethoxy-3-(4-methylpiperazin-1-yl)quinoxaline
CID 24853663
2-Methyl-3-((6-(piperidin-1-yl)pyridin-2-yl)methoxy)quinoxaline
CID 72706533
Benzyl cyano[3-(morpholin-4-yl)quinoxalin-2-yl]acetate
CID 662959
4-[3-[(4-Nitrophenyl)methoxy]quinoxalin-2-yl]morpholine
CID 2469334
4-[3-(2-Phenoxyethoxy)-2-quinoxalinyl]morpholine
CID 2562124
2-[(3-Chlorophenyl)methoxy]-3-(4-methylpiperazin-1-yl)quinoxaline
CID 24853595
2-(3-Methylphenoxy)-3-(4-methylpiperazin-1-yl)quinoxaline
CID 24853597
2-(4-Methylpiperazin-1-yl)-3-phenoxyquinoxaline
CID 24854637
2-(4-Methylpiperazin-1-yl)-3-(2-phenylethoxy)quinoxaline
CID 24854639
2-(4-Methylpiperazin-1-yl)-3-(pyridin-2-ylmethoxy)quinoxaline
CID 24854640

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylpiperazin-1-yl)-3-phenylmethoxyquinoxaline?
The IUPAC name of 2-(4-methylpiperazin-1-yl)-3-phenylmethoxyquinoxaline (CID 24854638) is 2-(4-methylpiperazin-1-yl)-3-phenylmethoxyquinoxaline.
What is the SMILES notation for 2-(4-methylpiperazin-1-yl)-3-phenylmethoxyquinoxaline?
The canonical SMILES for 2-(4-methylpiperazin-1-yl)-3-phenylmethoxyquinoxaline is CN1CCN(c2nc3ccccc3nc2OCc2ccccc2)CC1.
What is the InChIKey of 2-(4-methylpiperazin-1-yl)-3-phenylmethoxyquinoxaline?
The InChIKey is WQPDXBDZVNUMOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O/c1-23-11-13-24(14-12-23)19-20(25-15-16-7-3-2-4-8-16)22-18-10-6-5-9-17(18)21-19/h2-10H,11-15H2,1H3.
What are the key properties of 2-(4-methylpiperazin-1-yl)-3-phenylmethoxyquinoxaline?
2-(4-methylpiperazin-1-yl)-3-phenylmethoxyquinoxaline has a molecular weight of 334.42 g/mol, XLogP of 2.96, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylpiperazin-1-yl)-3-phenylmethoxyquinoxaline is sourced from PubChem (CID 24854638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).