N-(2-ethylphenyl)-2-[[2-(7-fluoro-4-oxoquinazolin-3-yl)acetyl]amino]acetamide

C20H19FN4O3 — CID 40750672

IUPACN-(2-ethylphenyl)-2-[[2-(7-fluoro-4-oxoquinazolin-3-yl)acetyl]amino]acetamide
SMILESCCc1ccccc1NC(=O)CNC(=O)Cn1cnc2cc(F)ccc2c1=O
InChIInChI=1S/C20H19FN4O3/c1-2-13-5-3-4-6-16(13)24-18(26)10-22-19(27)11-25-12-23-17-9-14(21)7-8-15(17)20(25)28/h3-9,12H,2,10-11H2,1H3,(H,22,27)(H,24,26)
InChIKeyCYEADYNSDDSGLB-UHFFFAOYSA-N
MW382.40 g/mol
LogP1.85
Rot. Bonds6

About N-(2-ethylphenyl)-2-[[2-(7-fluoro-4-oxoquinazolin-3-yl)acetyl]amino]acetamide

N-(2-ethylphenyl)-2-[[2-(7-fluoro-4-oxoquinazolin-3-yl)acetyl]amino]acetamide (PubChem CID 40750672) has the molecular formula C20H19FN4O3 and a molecular weight of 382.40 g/mol. Its IUPAC name is N-(2-ethylphenyl)-2-[[2-(7-fluoro-4-oxoquinazolin-3-yl)acetyl]amino]acetamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-2-[[2-(7-fluoro-4-oxoquinazolin-3-yl)acetyl]amino]acetamide
PubChem CID40750672
Molecular FormulaC20H19FN4O3
Molecular Weight382.40 g/mol
Exact Mass382.14
IUPAC NameN-(2-ethylphenyl)-2-[[2-(7-fluoro-4-oxoquinazolin-3-yl)acetyl]amino]acetamide
SMILESCCc1ccccc1NC(=O)CNC(=O)Cn1cnc2cc(F)ccc2c1=O
InChIInChI=1S/C20H19FN4O3/c1-2-13-5-3-4-6-16(13)24-18(26)10-22-19(27)11-25-12-23-17-9-14(21)7-8-15(17)20(25)28/h3-9,12H,2,10-11H2,1H3,(H,22,27)(H,24,26)
InChIKeyCYEADYNSDDSGLB-UHFFFAOYSA-N
XLogP1.85
TPSA93.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.40
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(2-ethylphenyl)-2-[[2-(7-fluoro-4-oxoquinazolin-3-yl)acetyl]amino]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2,3-dimethylphenyl)-2-(7-fluoro-4-oxoquinazolin-3-yl)acetamide
CID 40743513
2-(7-fluoro-4-oxoquinazolin-3-yl)-N-(4-methylphenyl)acetamide
CID 40743532
2-(7-fluoro-4-oxoquinazolin-3-yl)-N-(4-iodo-2-methylphenyl)acetamide
CID 27075653
2-(7-fluoro-4-oxoquinazolin-3-yl)-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide
CID 24524251
2-(7-fluoro-4-oxoquinazolin-3-yl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]acetamide
CID 17411760
N-[[4-(ethoxymethyl)phenyl]methyl]-2-(7-fluoro-4-oxoquinazolin-3-yl)acetamide
CID 167848621
[2-(2-ethylanilino)-2-oxoethyl] 2-(4-oxoquinazolin-3-yl)acetate
CID 7995489
N-(2-chloro-5-fluorophenyl)-2-(4-oxoquinazolin-3-yl)acetamide
CID 51363052
2-(7-fluoro-4-oxoquinazolin-3-yl)-N-(3-propan-2-yloxypropyl)acetamide
CID 24520750
N-(2,5-dichlorophenyl)-2-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]acetamide
CID 9440401
N-(2,5-dimethoxyphenyl)-2-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]acetamide
CID 3237928
2-(6-methyl-4-oxoquinazolin-3-yl)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 55733182

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-2-[[2-(7-fluoro-4-oxoquinazolin-3-yl)acetyl]amino]acetamide?
The IUPAC name of N-(2-ethylphenyl)-2-[[2-(7-fluoro-4-oxoquinazolin-3-yl)acetyl]amino]acetamide (CID 40750672) is N-(2-ethylphenyl)-2-[[2-(7-fluoro-4-oxoquinazolin-3-yl)acetyl]amino]acetamide.
What is the SMILES notation for N-(2-ethylphenyl)-2-[[2-(7-fluoro-4-oxoquinazolin-3-yl)acetyl]amino]acetamide?
The canonical SMILES for N-(2-ethylphenyl)-2-[[2-(7-fluoro-4-oxoquinazolin-3-yl)acetyl]amino]acetamide is CCc1ccccc1NC(=O)CNC(=O)Cn1cnc2cc(F)ccc2c1=O.
What is the InChIKey of N-(2-ethylphenyl)-2-[[2-(7-fluoro-4-oxoquinazolin-3-yl)acetyl]amino]acetamide?
The InChIKey is CYEADYNSDDSGLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19FN4O3/c1-2-13-5-3-4-6-16(13)24-18(26)10-22-19(27)11-25-12-23-17-9-14(21)7-8-15(17)20(25)28/h3-9,12H,2,10-11H2,1H3,(H,22,27)(H,24,26).
What are the key properties of N-(2-ethylphenyl)-2-[[2-(7-fluoro-4-oxoquinazolin-3-yl)acetyl]amino]acetamide?
N-(2-ethylphenyl)-2-[[2-(7-fluoro-4-oxoquinazolin-3-yl)acetyl]amino]acetamide has a molecular weight of 382.40 g/mol, XLogP of 1.85, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-2-[[2-(7-fluoro-4-oxoquinazolin-3-yl)acetyl]amino]acetamide is sourced from PubChem (CID 40750672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).