N-[2-(4-methoxyphenyl)-4-oxoquinazolin-3-yl]-2-phenylacetamide

C23H19N3O3 — CID 1213351

IUPACN-[2-(4-methoxyphenyl)-4-oxoquinazolin-3-yl]-2-phenylacetamide
SMILESCOc1ccc(-c2nc3ccccc3c(=O)n2NC(=O)Cc2ccccc2)cc1
InChIInChI=1S/C23H19N3O3/c1-29-18-13-11-17(12-14-18)22-24-20-10-6-5-9-19(20)23(28)26(22)25-21(27)15-16-7-3-2-4-8-16/h2-14H,15H2,1H3,(H,25,27)
InChIKeyWQWOXGVWUTUJRH-UHFFFAOYSA-N
MW385.42 g/mol
LogP3.38
Rot. Bonds5

About N-[2-(4-methoxyphenyl)-4-oxoquinazolin-3-yl]-2-phenylacetamide

N-[2-(4-methoxyphenyl)-4-oxoquinazolin-3-yl]-2-phenylacetamide (PubChem CID 1213351) has the molecular formula C23H19N3O3 and a molecular weight of 385.42 g/mol. Its IUPAC name is N-[2-(4-methoxyphenyl)-4-oxoquinazolin-3-yl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[2-(4-methoxyphenyl)-4-oxoquinazolin-3-yl]-2-phenylacetamide
PubChem CID1213351
Molecular FormulaC23H19N3O3
Molecular Weight385.42 g/mol
Exact Mass385.14
IUPAC NameN-[2-(4-methoxyphenyl)-4-oxoquinazolin-3-yl]-2-phenylacetamide
SMILESCOc1ccc(-c2nc3ccccc3c(=O)n2NC(=O)Cc2ccccc2)cc1
InChIInChI=1S/C23H19N3O3/c1-29-18-13-11-17(12-14-18)22-24-20-10-6-5-9-19(20)23(28)26(22)25-21(27)15-16-7-3-2-4-8-16/h2-14H,15H2,1H3,(H,25,27)
InChIKeyWQWOXGVWUTUJRH-UHFFFAOYSA-N
XLogP3.38
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.42
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methoxyphenyl)-4-oxoquinazolin-3-yl]-2-phenylacetamide?
The IUPAC name of N-[2-(4-methoxyphenyl)-4-oxoquinazolin-3-yl]-2-phenylacetamide (CID 1213351) is N-[2-(4-methoxyphenyl)-4-oxoquinazolin-3-yl]-2-phenylacetamide.
What is the SMILES notation for N-[2-(4-methoxyphenyl)-4-oxoquinazolin-3-yl]-2-phenylacetamide?
The canonical SMILES for N-[2-(4-methoxyphenyl)-4-oxoquinazolin-3-yl]-2-phenylacetamide is COc1ccc(-c2nc3ccccc3c(=O)n2NC(=O)Cc2ccccc2)cc1.
What is the InChIKey of N-[2-(4-methoxyphenyl)-4-oxoquinazolin-3-yl]-2-phenylacetamide?
The InChIKey is WQWOXGVWUTUJRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O3/c1-29-18-13-11-17(12-14-18)22-24-20-10-6-5-9-19(20)23(28)26(22)25-21(27)15-16-7-3-2-4-8-16/h2-14H,15H2,1H3,(H,25,27).
What are the key properties of N-[2-(4-methoxyphenyl)-4-oxoquinazolin-3-yl]-2-phenylacetamide?
N-[2-(4-methoxyphenyl)-4-oxoquinazolin-3-yl]-2-phenylacetamide has a molecular weight of 385.42 g/mol, XLogP of 3.38, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methoxyphenyl)-4-oxoquinazolin-3-yl]-2-phenylacetamide is sourced from PubChem (CID 1213351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).