4-[6-(4-quinoxalin-2-ylpiperazin-1-yl)pyrimidin-4-yl]morpholine

C20H23N7O — CID 154883208

IUPAC4-[6-(4-quinoxalin-2-ylpiperazin-1-yl)pyrimidin-4-yl]morpholine
SMILESc1ccc2nc(N3CCN(c4cc(N5CCOCC5)ncn4)CC3)cnc2c1
InChIInChI=1S/C20H23N7O/c1-2-4-17-16(3-1)21-14-20(24-17)26-7-5-25(6-8-26)18-13-19(23-15-22-18)27-9-11-28-12-10-27/h1-4,13-15H,5-12H2
InChIKeyLZERJZHQABVIIA-UHFFFAOYSA-N
MW377.45 g/mol
LogP1.58
Rot. Bonds3

About 4-[6-(4-quinoxalin-2-ylpiperazin-1-yl)pyrimidin-4-yl]morpholine

4-[6-(4-quinoxalin-2-ylpiperazin-1-yl)pyrimidin-4-yl]morpholine (PubChem CID 154883208) has the molecular formula C20H23N7O and a molecular weight of 377.45 g/mol. Its IUPAC name is 4-[6-(4-quinoxalin-2-ylpiperazin-1-yl)pyrimidin-4-yl]morpholine.

Molecular Properties

Compound Name4-[6-(4-quinoxalin-2-ylpiperazin-1-yl)pyrimidin-4-yl]morpholine
PubChem CID154883208
Molecular FormulaC20H23N7O
Molecular Weight377.45 g/mol
Exact Mass377.20
IUPAC Name4-[6-(4-quinoxalin-2-ylpiperazin-1-yl)pyrimidin-4-yl]morpholine
SMILESc1ccc2nc(N3CCN(c4cc(N5CCOCC5)ncn4)CC3)cnc2c1
InChIInChI=1S/C20H23N7O/c1-2-4-17-16(3-1)21-14-20(24-17)26-7-5-25(6-8-26)18-13-19(23-15-22-18)27-9-11-28-12-10-27/h1-4,13-15H,5-12H2
InChIKeyLZERJZHQABVIIA-UHFFFAOYSA-N
XLogP1.58
TPSA70.51 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.45
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Related Compounds

4-quinoxalin-2-yl-1,4-oxazepane
CID 134160732
4-[6-methyl-2-(4-quinoxalin-2-ylpiperazin-1-yl)pyrimidin-4-yl]morpholine
CID 154883227
2-[4-(oxan-4-yl)piperazin-1-yl]quinoxaline
CID 146046486
4-[6-(1,3-dihydroisoindol-2-yl)pyrimidin-4-yl]morpholine
CID 122282690
2-(4-hydroxypiperazin-1-yl)quinoxaline
CID 46878257
4-(6-morpholin-4-ylpyrimidin-4-yl)piperazine-1-carbaldehyde
CID 112857021
4-[7-(furan-2-yl)quinoxalin-2-yl]morpholine
CID 173105011
4-[7-(3,5-difluorophenyl)quinoxalin-2-yl]morpholine
CID 67035153
4-[6-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyrimidin-4-yl]morpholine
CID 122282533
bis(2-morpholin-4-ylquinoxalin-6-yl)methanone
CID 151491691
morpholin-4-yl-(1-quinoxalin-2-ylazetidin-3-yl)methanone
CID 163353090
4-(6-phenylpyrimidin-4-yl)morpholine
CID 1082059

Frequently Asked Questions

What is the IUPAC name of 4-[6-(4-quinoxalin-2-ylpiperazin-1-yl)pyrimidin-4-yl]morpholine?
The IUPAC name of 4-[6-(4-quinoxalin-2-ylpiperazin-1-yl)pyrimidin-4-yl]morpholine (CID 154883208) is 4-[6-(4-quinoxalin-2-ylpiperazin-1-yl)pyrimidin-4-yl]morpholine.
What is the SMILES notation for 4-[6-(4-quinoxalin-2-ylpiperazin-1-yl)pyrimidin-4-yl]morpholine?
The canonical SMILES for 4-[6-(4-quinoxalin-2-ylpiperazin-1-yl)pyrimidin-4-yl]morpholine is c1ccc2nc(N3CCN(c4cc(N5CCOCC5)ncn4)CC3)cnc2c1.
What is the InChIKey of 4-[6-(4-quinoxalin-2-ylpiperazin-1-yl)pyrimidin-4-yl]morpholine?
The InChIKey is LZERJZHQABVIIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N7O/c1-2-4-17-16(3-1)21-14-20(24-17)26-7-5-25(6-8-26)18-13-19(23-15-22-18)27-9-11-28-12-10-27/h1-4,13-15H,5-12H2.
What are the key properties of 4-[6-(4-quinoxalin-2-ylpiperazin-1-yl)pyrimidin-4-yl]morpholine?
4-[6-(4-quinoxalin-2-ylpiperazin-1-yl)pyrimidin-4-yl]morpholine has a molecular weight of 377.45 g/mol, XLogP of 1.58, 3 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-(4-quinoxalin-2-ylpiperazin-1-yl)pyrimidin-4-yl]morpholine is sourced from PubChem (CID 154883208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).