1-morpholin-4-yl-2-[4-[3-(4-morpholin-4-ylphenyl)quinoxalin-5-yl]phenyl]ethanone

C30H30N4O3 — CID 59392811

IUPAC1-morpholin-4-yl-2-[4-[3-(4-morpholin-4-ylphenyl)quinoxalin-5-yl]phenyl]ethanone
SMILESO=C(Cc1ccc(-c2cccc3ncc(-c4ccc(N5CCOCC5)cc4)nc23)cc1)N1CCOCC1
InChIInChI=1S/C30H30N4O3/c35-29(34-14-18-37-19-15-34)20-22-4-6-23(7-5-22)26-2-1-3-27-30(26)32-28(21-31-27)24-8-10-25(11-9-24)33-12-16-36-17-13-33/h1-11,21H,12-20H2
InChIKeyXQOSGLFTCKTZCQ-UHFFFAOYSA-N
MW494.60 g/mol
LogP4.20
Rot. Bonds5

About 1-morpholin-4-yl-2-[4-[3-(4-morpholin-4-ylphenyl)quinoxalin-5-yl]phenyl]ethanone

1-morpholin-4-yl-2-[4-[3-(4-morpholin-4-ylphenyl)quinoxalin-5-yl]phenyl]ethanone (PubChem CID 59392811) has the molecular formula C30H30N4O3 and a molecular weight of 494.60 g/mol. Its IUPAC name is 1-morpholin-4-yl-2-[4-[3-(4-morpholin-4-ylphenyl)quinoxalin-5-yl]phenyl]ethanone.

Molecular Properties

Compound Name1-morpholin-4-yl-2-[4-[3-(4-morpholin-4-ylphenyl)quinoxalin-5-yl]phenyl]ethanone
PubChem CID59392811
Molecular FormulaC30H30N4O3
Molecular Weight494.60 g/mol
Exact Mass494.23
IUPAC Name1-morpholin-4-yl-2-[4-[3-(4-morpholin-4-ylphenyl)quinoxalin-5-yl]phenyl]ethanone
SMILESO=C(Cc1ccc(-c2cccc3ncc(-c4ccc(N5CCOCC5)cc4)nc23)cc1)N1CCOCC1
InChIInChI=1S/C30H30N4O3/c35-29(34-14-18-37-19-15-34)20-22-4-6-23(7-5-22)26-2-1-3-27-30(26)32-28(21-31-27)24-8-10-25(11-9-24)33-12-16-36-17-13-33/h1-11,21H,12-20H2
InChIKeyXQOSGLFTCKTZCQ-UHFFFAOYSA-N
XLogP4.20
TPSA67.79 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms37
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500494.60
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 1-morpholin-4-yl-2-[4-[3-(4-morpholin-4-ylphenyl)quinoxalin-5-yl]phenyl]ethanone with MolForge

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Related Compounds

2-[2-fluoro-4-[3-[4-(4-methylpiperazin-1-yl)phenyl]quinoxalin-5-yl]phenyl]-1-morpholin-4-ylethanone
CID 59392752
[2-methyl-4-[3-(4-morpholin-4-ylphenyl)quinoxalin-5-yl]phenyl]-morpholin-4-ylmethanone
CID 59392747
1-(1,1-dioxo-1,4-thiazinan-4-yl)-2-[4-[3-(3,4,5-trimethoxyphenyl)quinoxalin-5-yl]phenyl]ethanone
CID 25123472
[2-methyl-4-[8-[3-methyl-4-(morpholin-4-ylmethyl)phenyl]quinoxalin-2-yl]phenyl]-morpholin-4-ylmethanone
CID 46885234
1-(4-benzylpiperazin-1-yl)-2-(4-morpholin-4-ylphenyl)ethanone
CID 110411980
N-(2-hydroxyethyl)-4-[[7-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]-1,3-benzoxazol-2-yl]amino]benzamide
CID 71122857
2-[4-[2-(4-methylsulfonylanilino)-1,3-benzoxazol-7-yl]phenyl]-1-morpholin-4-ylethanone
CID 67458919
1-[2-(4-morpholin-4-ylphenyl)acetyl]piperidine-4-carboxamide
CID 110675153
4-[8-[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]quinoxalin-2-yl]-N,N,2-trimethylbenzamide
CID 59392667
N-hydroxy-3-(4-morpholin-4-ylphenyl)quinoxaline-6-carboxamide
CID 162733690
4-[4-[2-[(4-morpholin-4-ylphenyl)methyl]pyrimidin-4-yl]phenyl]-3-oxobutanenitrile
CID 157074303
(2-morpholin-4-yl-2-oxoethyl) quinoxaline-2-carboxylate
CID 23773714

Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-2-[4-[3-(4-morpholin-4-ylphenyl)quinoxalin-5-yl]phenyl]ethanone?
The IUPAC name of 1-morpholin-4-yl-2-[4-[3-(4-morpholin-4-ylphenyl)quinoxalin-5-yl]phenyl]ethanone (CID 59392811) is 1-morpholin-4-yl-2-[4-[3-(4-morpholin-4-ylphenyl)quinoxalin-5-yl]phenyl]ethanone.
What is the SMILES notation for 1-morpholin-4-yl-2-[4-[3-(4-morpholin-4-ylphenyl)quinoxalin-5-yl]phenyl]ethanone?
The canonical SMILES for 1-morpholin-4-yl-2-[4-[3-(4-morpholin-4-ylphenyl)quinoxalin-5-yl]phenyl]ethanone is O=C(Cc1ccc(-c2cccc3ncc(-c4ccc(N5CCOCC5)cc4)nc23)cc1)N1CCOCC1.
What is the InChIKey of 1-morpholin-4-yl-2-[4-[3-(4-morpholin-4-ylphenyl)quinoxalin-5-yl]phenyl]ethanone?
The InChIKey is XQOSGLFTCKTZCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H30N4O3/c35-29(34-14-18-37-19-15-34)20-22-4-6-23(7-5-22)26-2-1-3-27-30(26)32-28(21-31-27)24-8-10-25(11-9-24)33-12-16-36-17-13-33/h1-11,21H,12-20H2.
What are the key properties of 1-morpholin-4-yl-2-[4-[3-(4-morpholin-4-ylphenyl)quinoxalin-5-yl]phenyl]ethanone?
1-morpholin-4-yl-2-[4-[3-(4-morpholin-4-ylphenyl)quinoxalin-5-yl]phenyl]ethanone has a molecular weight of 494.60 g/mol, XLogP of 4.20, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-2-[4-[3-(4-morpholin-4-ylphenyl)quinoxalin-5-yl]phenyl]ethanone is sourced from PubChem (CID 59392811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).