N-(2-ethylphenyl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide

C19H19N3O2 — CID 19164668

IUPACN-(2-ethylphenyl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide
SMILESCCc1ccccc1NC(=O)CCc1nc2ccccc2[nH]c1=O
InChIInChI=1S/C19H19N3O2/c1-2-13-7-3-4-8-14(13)21-18(23)12-11-17-19(24)22-16-10-6-5-9-15(16)20-17/h3-10H,2,11-12H2,1H3,(H,21,23)(H,22,24)
InChIKeyDMQZCFFRBLPSCY-UHFFFAOYSA-N
MW321.38 g/mol
LogP3.06
Rot. Bonds5

About N-(2-ethylphenyl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide

N-(2-ethylphenyl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide (PubChem CID 19164668) has the molecular formula C19H19N3O2 and a molecular weight of 321.38 g/mol. Its IUPAC name is N-(2-ethylphenyl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide
PubChem CID19164668
Molecular FormulaC19H19N3O2
Molecular Weight321.38 g/mol
Exact Mass321.15
IUPAC NameN-(2-ethylphenyl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide
SMILESCCc1ccccc1NC(=O)CCc1nc2ccccc2[nH]c1=O
InChIInChI=1S/C19H19N3O2/c1-2-13-7-3-4-8-14(13)21-18(23)12-11-17-19(24)22-16-10-6-5-9-15(16)20-17/h3-10H,2,11-12H2,1H3,(H,21,23)(H,22,24)
InChIKeyDMQZCFFRBLPSCY-UHFFFAOYSA-N
XLogP3.06
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,6-dimethylphenyl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide
CID 19164666
N-(4-ethoxyphenyl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide
CID 19164677
N-[2-[(3-oxo-4H-quinoxalin-2-yl)methyl]phenyl]acetamide
CID 11709106
N-[2,6-di(propan-2-yl)phenyl]-3-(3-oxo-4H-quinoxalin-2-yl)propanamide
CID 19164657
N-(4-methyl-2-pyridinyl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide
CID 19164738
N-(cyanomethyl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide
CID 82299514
N-(3-ethylsulfanyl-1H-1,2,4-triazol-5-yl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide
CID 108733038
N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide
CID 19164774
N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-3-(3-oxo-4H-quinoxalin-2-yl)propanamide
CID 108727285
N-[(E)-benzylideneamino]-3-(3-oxo-4H-quinoxalin-2-yl)propanamide
CID 6877145
3-(3-oxo-4H-quinoxalin-2-yl)-N-[1-(4-propan-2-ylphenyl)ethyl]propanamide
CID 19164914
N-(1H-indol-3-ylmethyl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide
CID 110673247

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide?
The IUPAC name of N-(2-ethylphenyl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide (CID 19164668) is N-(2-ethylphenyl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide.
What is the SMILES notation for N-(2-ethylphenyl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide?
The canonical SMILES for N-(2-ethylphenyl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide is CCc1ccccc1NC(=O)CCc1nc2ccccc2[nH]c1=O.
What is the InChIKey of N-(2-ethylphenyl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide?
The InChIKey is DMQZCFFRBLPSCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2/c1-2-13-7-3-4-8-14(13)21-18(23)12-11-17-19(24)22-16-10-6-5-9-15(16)20-17/h3-10H,2,11-12H2,1H3,(H,21,23)(H,22,24).
What are the key properties of N-(2-ethylphenyl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide?
N-(2-ethylphenyl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide has a molecular weight of 321.38 g/mol, XLogP of 3.06, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide is sourced from PubChem (CID 19164668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).