N-ethyl-N-[(3-fluorophenyl)methyl]-2-(2-oxoquinoxalin-1-yl)acetamide

C19H18FN3O2 — CID 31977722

IUPACN-ethyl-N-[(3-fluorophenyl)methyl]-2-(2-oxoquinoxalin-1-yl)acetamide
SMILESCCN(Cc1cccc(F)c1)C(=O)Cn1c(=O)cnc2ccccc21
InChIInChI=1S/C19H18FN3O2/c1-2-22(12-14-6-5-7-15(20)10-14)19(25)13-23-17-9-4-3-8-16(17)21-11-18(23)24/h3-11H,2,12-13H2,1H3
InChIKeyPMXLHHJBKXSMHT-UHFFFAOYSA-N
MW339.37 g/mol
LogP2.58
Rot. Bonds5

About N-ethyl-N-[(3-fluorophenyl)methyl]-2-(2-oxoquinoxalin-1-yl)acetamide

N-ethyl-N-[(3-fluorophenyl)methyl]-2-(2-oxoquinoxalin-1-yl)acetamide (PubChem CID 31977722) has the molecular formula C19H18FN3O2 and a molecular weight of 339.37 g/mol. Its IUPAC name is N-ethyl-N-[(3-fluorophenyl)methyl]-2-(2-oxoquinoxalin-1-yl)acetamide.

Molecular Properties

Compound NameN-ethyl-N-[(3-fluorophenyl)methyl]-2-(2-oxoquinoxalin-1-yl)acetamide
PubChem CID31977722
Molecular FormulaC19H18FN3O2
Molecular Weight339.37 g/mol
Exact Mass339.14
IUPAC NameN-ethyl-N-[(3-fluorophenyl)methyl]-2-(2-oxoquinoxalin-1-yl)acetamide
SMILESCCN(Cc1cccc(F)c1)C(=O)Cn1c(=O)cnc2ccccc21
InChIInChI=1S/C19H18FN3O2/c1-2-22(12-14-6-5-7-15(20)10-14)19(25)13-23-17-9-4-3-8-16(17)21-11-18(23)24/h3-11H,2,12-13H2,1H3
InChIKeyPMXLHHJBKXSMHT-UHFFFAOYSA-N
XLogP2.58
TPSA55.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.37
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]-2-(2-oxoquinoxalin-1-yl)acetamide
CID 9321843
N-ethyl-2-(2-oxoquinoxalin-1-yl)-N-(2-pyrazol-1-ylethyl)acetamide
CID 72844302
2-(2-oxoquinoxalin-1-yl)-N,N-bis(thiophen-2-ylmethyl)acetamide
CID 31839493
N-methyl-N-[(4-methylsulfanylphenyl)methyl]-2-(2-oxoquinoxalin-1-yl)acetamide
CID 26883298
N-ethyl-3-(3-ethyl-2-oxobenzimidazol-1-yl)-N-[(3-fluorophenyl)methyl]propanamide
CID 18116161
N-ethyl-N-[(3-fluorophenyl)methyl]-3-(3-methyl-2-oxobenzimidazol-1-yl)propanamide
CID 18169326
2-(3-benzyl-2,4,5-trioxoimidazolidin-1-yl)-N-ethyl-N-[(3-fluorophenyl)methyl]acetamide
CID 9072690
2-(2-oxoquinoxalin-1-yl)-N-(2-phenylethyl)-N-(thiophen-2-ylmethyl)acetamide
CID 17409812
2-chloro-N-ethyl-N-[(3-fluorophenyl)methyl]acetamide
CID 9317159
N-[2-(5-chloro-2-methylanilino)-2-oxoethyl]-N-ethyl-2-(2-oxoquinoxalin-1-yl)acetamide
CID 24686704
2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)-N-ethyl-N-[(3-fluorophenyl)methyl]acetamide
CID 8576675
N-[(3-fluorophenyl)methyl]-N-methyl-2-(9-oxoacridin-10-yl)acetamide
CID 18144983

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[(3-fluorophenyl)methyl]-2-(2-oxoquinoxalin-1-yl)acetamide?
The IUPAC name of N-ethyl-N-[(3-fluorophenyl)methyl]-2-(2-oxoquinoxalin-1-yl)acetamide (CID 31977722) is N-ethyl-N-[(3-fluorophenyl)methyl]-2-(2-oxoquinoxalin-1-yl)acetamide.
What is the SMILES notation for N-ethyl-N-[(3-fluorophenyl)methyl]-2-(2-oxoquinoxalin-1-yl)acetamide?
The canonical SMILES for N-ethyl-N-[(3-fluorophenyl)methyl]-2-(2-oxoquinoxalin-1-yl)acetamide is CCN(Cc1cccc(F)c1)C(=O)Cn1c(=O)cnc2ccccc21.
What is the InChIKey of N-ethyl-N-[(3-fluorophenyl)methyl]-2-(2-oxoquinoxalin-1-yl)acetamide?
The InChIKey is PMXLHHJBKXSMHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN3O2/c1-2-22(12-14-6-5-7-15(20)10-14)19(25)13-23-17-9-4-3-8-16(17)21-11-18(23)24/h3-11H,2,12-13H2,1H3.
What are the key properties of N-ethyl-N-[(3-fluorophenyl)methyl]-2-(2-oxoquinoxalin-1-yl)acetamide?
N-ethyl-N-[(3-fluorophenyl)methyl]-2-(2-oxoquinoxalin-1-yl)acetamide has a molecular weight of 339.37 g/mol, XLogP of 2.58, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[(3-fluorophenyl)methyl]-2-(2-oxoquinoxalin-1-yl)acetamide is sourced from PubChem (CID 31977722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).