N-(4-acetylphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide

C20H19N3O3 — CID 859989

IUPACN-(4-acetylphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide
SMILESCCc1nc2ccccc2c(=O)n1CC(=O)Nc1ccc(C(C)=O)cc1
InChIInChI=1S/C20H19N3O3/c1-3-18-22-17-7-5-4-6-16(17)20(26)23(18)12-19(25)21-15-10-8-14(9-11-15)13(2)24/h4-11H,3,12H2,1-2H3,(H,21,25)
InChIKeyJEYYEHQYTDLPFN-UHFFFAOYSA-N
MW349.39 g/mol
LogP2.80
Rot. Bonds5

About N-(4-acetylphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide

N-(4-acetylphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide (PubChem CID 859989) has the molecular formula C20H19N3O3 and a molecular weight of 349.39 g/mol. Its IUPAC name is N-(4-acetylphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide
PubChem CID859989
Molecular FormulaC20H19N3O3
Molecular Weight349.39 g/mol
Exact Mass349.14
IUPAC NameN-(4-acetylphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide
SMILESCCc1nc2ccccc2c(=O)n1CC(=O)Nc1ccc(C(C)=O)cc1
InChIInChI=1S/C20H19N3O3/c1-3-18-22-17-7-5-4-6-16(17)20(26)23(18)12-19(25)21-15-10-8-14(9-11-15)13(2)24/h4-11H,3,12H2,1-2H3,(H,21,25)
InChIKeyJEYYEHQYTDLPFN-UHFFFAOYSA-N
XLogP2.80
TPSA81.06 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(dimethylamino)phenyl]-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide
CID 45030780
2-(2-ethyl-4-oxoquinazolin-3-yl)-N-(4-phenoxyphenyl)acetamide
CID 45030855
2-(2-ethyl-4-oxoquinazolin-3-yl)-N-(3-fluoro-4-methylphenyl)acetamide
CID 45030818
N-butyl-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide
CID 45030782
N-(4-methylphenyl)-2-[4-oxo-2-(piperidin-1-ylmethyl)quinazolin-3-yl]acetamide
CID 4606267
N-(2,5-dimethoxyphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide
CID 4984690
2-(2-ethyl-4-oxoquinazolin-3-yl)-N-[(2S)-4-phenylbutan-2-yl]acetamide
CID 51981540
N-(4-acetylphenyl)-2-(4-oxo-3-propylquinazolin-2-yl)sulfanylpropanamide
CID 42963659
N-(4-acetylphenyl)-2-(4-methyl-1-oxophthalazin-2-yl)acetamide
CID 857342
N-(4-acetylphenyl)-2-(3-methyl-2-oxoquinolin-1-yl)acetamide
CID 110680389
4-[[2-[2-(4-acetylanilino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]methyl]-N-propylbenzamide
CID 46351087
N-(4-ethoxyphenyl)-2-(2-ethylbenzimidazol-1-yl)acetamide
CID 3460449

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide?
The IUPAC name of N-(4-acetylphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide (CID 859989) is N-(4-acetylphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide.
What is the SMILES notation for N-(4-acetylphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide?
The canonical SMILES for N-(4-acetylphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide is CCc1nc2ccccc2c(=O)n1CC(=O)Nc1ccc(C(C)=O)cc1.
What is the InChIKey of N-(4-acetylphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide?
The InChIKey is JEYYEHQYTDLPFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3/c1-3-18-22-17-7-5-4-6-16(17)20(26)23(18)12-19(25)21-15-10-8-14(9-11-15)13(2)24/h4-11H,3,12H2,1-2H3,(H,21,25).
What are the key properties of N-(4-acetylphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide?
N-(4-acetylphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide has a molecular weight of 349.39 g/mol, XLogP of 2.80, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide is sourced from PubChem (CID 859989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).