7-methyl-3-(morpholine-4-carbonyl)-6-morpholin-4-yl-1H-quinoxalin-2-one

C18H22N4O4 — CID 59874499

IUPAC7-methyl-3-(morpholine-4-carbonyl)-6-morpholin-4-yl-1H-quinoxalin-2-one
SMILESCc1cc2[nH]c(=O)c(C(=O)N3CCOCC3)nc2cc1N1CCOCC1
InChIInChI=1S/C18H22N4O4/c1-12-10-13-14(11-15(12)21-2-6-25-7-3-21)19-16(17(23)20-13)18(24)22-4-8-26-9-5-22/h10-11H,2-9H2,1H3,(H,20,23)
InChIKeyFATQOAVABFSNLO-UHFFFAOYSA-N
MW358.40 g/mol
LogP0.54
Rot. Bonds2

About 7-methyl-3-(morpholine-4-carbonyl)-6-morpholin-4-yl-1H-quinoxalin-2-one

7-methyl-3-(morpholine-4-carbonyl)-6-morpholin-4-yl-1H-quinoxalin-2-one (PubChem CID 59874499) has the molecular formula C18H22N4O4 and a molecular weight of 358.40 g/mol. Its IUPAC name is 7-methyl-3-(morpholine-4-carbonyl)-6-morpholin-4-yl-1H-quinoxalin-2-one.

Molecular Properties

Compound Name7-methyl-3-(morpholine-4-carbonyl)-6-morpholin-4-yl-1H-quinoxalin-2-one
PubChem CID59874499
Molecular FormulaC18H22N4O4
Molecular Weight358.40 g/mol
Exact Mass358.16
IUPAC Name7-methyl-3-(morpholine-4-carbonyl)-6-morpholin-4-yl-1H-quinoxalin-2-one
SMILESCc1cc2[nH]c(=O)c(C(=O)N3CCOCC3)nc2cc1N1CCOCC1
InChIInChI=1S/C18H22N4O4/c1-12-10-13-14(11-15(12)21-2-6-25-7-3-21)19-16(17(23)20-13)18(24)22-4-8-26-9-5-22/h10-11H,2-9H2,1H3,(H,20,23)
InChIKeyFATQOAVABFSNLO-UHFFFAOYSA-N
XLogP0.54
TPSA87.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.40
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-3-(morpholine-4-carbonyl)-6-morpholin-4-yl-1H-quinoxalin-2-one?
The IUPAC name of 7-methyl-3-(morpholine-4-carbonyl)-6-morpholin-4-yl-1H-quinoxalin-2-one (CID 59874499) is 7-methyl-3-(morpholine-4-carbonyl)-6-morpholin-4-yl-1H-quinoxalin-2-one.
What is the SMILES notation for 7-methyl-3-(morpholine-4-carbonyl)-6-morpholin-4-yl-1H-quinoxalin-2-one?
The canonical SMILES for 7-methyl-3-(morpholine-4-carbonyl)-6-morpholin-4-yl-1H-quinoxalin-2-one is Cc1cc2[nH]c(=O)c(C(=O)N3CCOCC3)nc2cc1N1CCOCC1.
What is the InChIKey of 7-methyl-3-(morpholine-4-carbonyl)-6-morpholin-4-yl-1H-quinoxalin-2-one?
The InChIKey is FATQOAVABFSNLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O4/c1-12-10-13-14(11-15(12)21-2-6-25-7-3-21)19-16(17(23)20-13)18(24)22-4-8-26-9-5-22/h10-11H,2-9H2,1H3,(H,20,23).
What are the key properties of 7-methyl-3-(morpholine-4-carbonyl)-6-morpholin-4-yl-1H-quinoxalin-2-one?
7-methyl-3-(morpholine-4-carbonyl)-6-morpholin-4-yl-1H-quinoxalin-2-one has a molecular weight of 358.40 g/mol, XLogP of 0.54, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-3-(morpholine-4-carbonyl)-6-morpholin-4-yl-1H-quinoxalin-2-one is sourced from PubChem (CID 59874499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).