N-(7-fluoro-4-oxo-3H-quinazolin-6-yl)-2-(2-methoxyphenyl)acetamide

C17H14FN3O3 — CID 135903572

IUPACN-(7-fluoro-4-oxo-3H-quinazolin-6-yl)-2-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1CC(=O)Nc1cc2c(=O)[nH]cnc2cc1F
InChIInChI=1S/C17H14FN3O3/c1-24-15-5-3-2-4-10(15)6-16(22)21-14-7-11-13(8-12(14)18)19-9-20-17(11)23/h2-5,7-9H,6H2,1H3,(H,21,22)(H,19,20,23)
InChIKeyZZCJNYRPMOQFLL-UHFFFAOYSA-N
MW327.32 g/mol
LogP2.25
Rot. Bonds4

About N-(7-fluoro-4-oxo-3H-quinazolin-6-yl)-2-(2-methoxyphenyl)acetamide

N-(7-fluoro-4-oxo-3H-quinazolin-6-yl)-2-(2-methoxyphenyl)acetamide (PubChem CID 135903572) has the molecular formula C17H14FN3O3 and a molecular weight of 327.32 g/mol. Its IUPAC name is N-(7-fluoro-4-oxo-3H-quinazolin-6-yl)-2-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-(7-fluoro-4-oxo-3H-quinazolin-6-yl)-2-(2-methoxyphenyl)acetamide
PubChem CID135903572
Molecular FormulaC17H14FN3O3
Molecular Weight327.32 g/mol
Exact Mass327.10
IUPAC NameN-(7-fluoro-4-oxo-3H-quinazolin-6-yl)-2-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1CC(=O)Nc1cc2c(=O)[nH]cnc2cc1F
InChIInChI=1S/C17H14FN3O3/c1-24-15-5-3-2-4-10(15)6-16(22)21-14-7-11-13(8-12(14)18)19-9-20-17(11)23/h2-5,7-9H,6H2,1H3,(H,21,22)(H,19,20,23)
InChIKeyZZCJNYRPMOQFLL-UHFFFAOYSA-N
XLogP2.25
TPSA84.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.32
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N-(7-fluoro-4-oxo-3H-quinazolin-6-yl)-2-methylsulfanylbutanamide
CID 136849071
N-(4-fluoro-2-methoxyphenyl)-2-(2-methoxyphenyl)acetamide
CID 32608110
7-fluoro-6-(methylamino)-3H-quinazolin-4-one
CID 146792791
2-(3H-benzimidazol-5-yl)-N-(2-methoxyphenyl)acetamide
CID 110772471
2-(2-methoxyphenyl)-N-(6-oxo-2-pyrazol-1-yl-1H-pyrimidin-5-yl)acetamide
CID 53493772
N-(1,4-dioxo-2,3-dihydrophthalazin-6-yl)-2-(2-methoxyphenyl)acetamide
CID 110734555
2-(2-methoxyphenyl)-N-(2,4,5-trichlorophenyl)acetamide
CID 3375078
N-(2-amino-5-methoxyphenyl)-2-(2-methoxyphenyl)acetamide
CID 63257795
N'-(2-fluorophenyl)-N-[(2-methoxyphenyl)methyl]propanediamide
CID 108946915
N-(2-amino-4-hydroxyphenyl)-2-(2-methoxyphenyl)acetamide
CID 107697668
N-(2,5-dimethoxyphenyl)-2-(2-fluorophenyl)acetamide
CID 1228251
N-[(5-fluoro-2-methoxyphenyl)methyl]-2-(2-methoxyphenyl)acetamide
CID 110780208

Frequently Asked Questions

What is the IUPAC name of N-(7-fluoro-4-oxo-3H-quinazolin-6-yl)-2-(2-methoxyphenyl)acetamide?
The IUPAC name of N-(7-fluoro-4-oxo-3H-quinazolin-6-yl)-2-(2-methoxyphenyl)acetamide (CID 135903572) is N-(7-fluoro-4-oxo-3H-quinazolin-6-yl)-2-(2-methoxyphenyl)acetamide.
What is the SMILES notation for N-(7-fluoro-4-oxo-3H-quinazolin-6-yl)-2-(2-methoxyphenyl)acetamide?
The canonical SMILES for N-(7-fluoro-4-oxo-3H-quinazolin-6-yl)-2-(2-methoxyphenyl)acetamide is COc1ccccc1CC(=O)Nc1cc2c(=O)[nH]cnc2cc1F.
What is the InChIKey of N-(7-fluoro-4-oxo-3H-quinazolin-6-yl)-2-(2-methoxyphenyl)acetamide?
The InChIKey is ZZCJNYRPMOQFLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FN3O3/c1-24-15-5-3-2-4-10(15)6-16(22)21-14-7-11-13(8-12(14)18)19-9-20-17(11)23/h2-5,7-9H,6H2,1H3,(H,21,22)(H,19,20,23).
What are the key properties of N-(7-fluoro-4-oxo-3H-quinazolin-6-yl)-2-(2-methoxyphenyl)acetamide?
N-(7-fluoro-4-oxo-3H-quinazolin-6-yl)-2-(2-methoxyphenyl)acetamide has a molecular weight of 327.32 g/mol, XLogP of 2.25, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-fluoro-4-oxo-3H-quinazolin-6-yl)-2-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 135903572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).