2-[3-(diethylamino)-2-oxoquinoxalin-1-yl]-N-(2,4-difluorophenyl)acetamide

C20H20F2N4O2 — CID 2095650

IUPAC2-[3-(diethylamino)-2-oxoquinoxalin-1-yl]-N-(2,4-difluorophenyl)acetamide
SMILESCCN(CC)c1nc2ccccc2n(CC(=O)Nc2ccc(F)cc2F)c1=O
InChIInChI=1S/C20H20F2N4O2/c1-3-25(4-2)19-20(28)26(17-8-6-5-7-16(17)24-19)12-18(27)23-15-10-9-13(21)11-14(15)22/h5-11H,3-4,12H2,1-2H3,(H,23,27)
InChIKeyHJGDNAAEAGSRRF-UHFFFAOYSA-N
MW386.40 g/mol
LogP3.16
Rot. Bonds6

About 2-[3-(diethylamino)-2-oxoquinoxalin-1-yl]-N-(2,4-difluorophenyl)acetamide

2-[3-(diethylamino)-2-oxoquinoxalin-1-yl]-N-(2,4-difluorophenyl)acetamide (PubChem CID 2095650) has the molecular formula C20H20F2N4O2 and a molecular weight of 386.40 g/mol. Its IUPAC name is 2-[3-(diethylamino)-2-oxoquinoxalin-1-yl]-N-(2,4-difluorophenyl)acetamide.

Molecular Properties

Compound Name2-[3-(diethylamino)-2-oxoquinoxalin-1-yl]-N-(2,4-difluorophenyl)acetamide
PubChem CID2095650
Molecular FormulaC20H20F2N4O2
Molecular Weight386.40 g/mol
Exact Mass386.16
IUPAC Name2-[3-(diethylamino)-2-oxoquinoxalin-1-yl]-N-(2,4-difluorophenyl)acetamide
SMILESCCN(CC)c1nc2ccccc2n(CC(=O)Nc2ccc(F)cc2F)c1=O
InChIInChI=1S/C20H20F2N4O2/c1-3-25(4-2)19-20(28)26(17-8-6-5-7-16(17)24-19)12-18(27)23-15-10-9-13(21)11-14(15)22/h5-11H,3-4,12H2,1-2H3,(H,23,27)
InChIKeyHJGDNAAEAGSRRF-UHFFFAOYSA-N
XLogP3.16
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.40
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(diethylamino)-2-oxoquinoxalin-1-yl]-N-(2,4-difluorophenyl)acetamide?
The IUPAC name of 2-[3-(diethylamino)-2-oxoquinoxalin-1-yl]-N-(2,4-difluorophenyl)acetamide (CID 2095650) is 2-[3-(diethylamino)-2-oxoquinoxalin-1-yl]-N-(2,4-difluorophenyl)acetamide.
What is the SMILES notation for 2-[3-(diethylamino)-2-oxoquinoxalin-1-yl]-N-(2,4-difluorophenyl)acetamide?
The canonical SMILES for 2-[3-(diethylamino)-2-oxoquinoxalin-1-yl]-N-(2,4-difluorophenyl)acetamide is CCN(CC)c1nc2ccccc2n(CC(=O)Nc2ccc(F)cc2F)c1=O.
What is the InChIKey of 2-[3-(diethylamino)-2-oxoquinoxalin-1-yl]-N-(2,4-difluorophenyl)acetamide?
The InChIKey is HJGDNAAEAGSRRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20F2N4O2/c1-3-25(4-2)19-20(28)26(17-8-6-5-7-16(17)24-19)12-18(27)23-15-10-9-13(21)11-14(15)22/h5-11H,3-4,12H2,1-2H3,(H,23,27).
What are the key properties of 2-[3-(diethylamino)-2-oxoquinoxalin-1-yl]-N-(2,4-difluorophenyl)acetamide?
2-[3-(diethylamino)-2-oxoquinoxalin-1-yl]-N-(2,4-difluorophenyl)acetamide has a molecular weight of 386.40 g/mol, XLogP of 3.16, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(diethylamino)-2-oxoquinoxalin-1-yl]-N-(2,4-difluorophenyl)acetamide is sourced from PubChem (CID 2095650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).