N-(4-oxo-2-phenyl-1,2-dihydroquinazolin-3-yl)-2-phenoxyacetamide

C22H19N3O3 — CID 18886893

IUPACN-(4-oxo-2-phenyl-1,2-dihydroquinazolin-3-yl)-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)NN1C(=O)c2ccccc2NC1c1ccccc1
InChIInChI=1S/C22H19N3O3/c26-20(15-28-17-11-5-2-6-12-17)24-25-21(16-9-3-1-4-10-16)23-19-14-8-7-13-18(19)22(25)27/h1-14,21,23H,15H2,(H,24,26)
InChIKeyVAKOKAXKTCAGCM-UHFFFAOYSA-N
MW373.41 g/mol
LogP3.36
Rot. Bonds5

About N-(4-oxo-2-phenyl-1,2-dihydroquinazolin-3-yl)-2-phenoxyacetamide

N-(4-oxo-2-phenyl-1,2-dihydroquinazolin-3-yl)-2-phenoxyacetamide (PubChem CID 18886893) has the molecular formula C22H19N3O3 and a molecular weight of 373.41 g/mol. Its IUPAC name is N-(4-oxo-2-phenyl-1,2-dihydroquinazolin-3-yl)-2-phenoxyacetamide.

Molecular Properties

Compound NameN-(4-oxo-2-phenyl-1,2-dihydroquinazolin-3-yl)-2-phenoxyacetamide
PubChem CID18886893
Molecular FormulaC22H19N3O3
Molecular Weight373.41 g/mol
Exact Mass373.14
IUPAC NameN-(4-oxo-2-phenyl-1,2-dihydroquinazolin-3-yl)-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)NN1C(=O)c2ccccc2NC1c1ccccc1
InChIInChI=1S/C22H19N3O3/c26-20(15-28-17-11-5-2-6-12-17)24-25-21(16-9-3-1-4-10-16)23-19-14-8-7-13-18(19)22(25)27/h1-14,21,23H,15H2,(H,24,26)
InChIKeyVAKOKAXKTCAGCM-UHFFFAOYSA-N
XLogP3.36
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.41
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-oxo-2-phenyl-1,2-dihydroquinazolin-3-yl)-2-phenoxyacetamide?
The IUPAC name of N-(4-oxo-2-phenyl-1,2-dihydroquinazolin-3-yl)-2-phenoxyacetamide (CID 18886893) is N-(4-oxo-2-phenyl-1,2-dihydroquinazolin-3-yl)-2-phenoxyacetamide.
What is the SMILES notation for N-(4-oxo-2-phenyl-1,2-dihydroquinazolin-3-yl)-2-phenoxyacetamide?
The canonical SMILES for N-(4-oxo-2-phenyl-1,2-dihydroquinazolin-3-yl)-2-phenoxyacetamide is O=C(COc1ccccc1)NN1C(=O)c2ccccc2NC1c1ccccc1.
What is the InChIKey of N-(4-oxo-2-phenyl-1,2-dihydroquinazolin-3-yl)-2-phenoxyacetamide?
The InChIKey is VAKOKAXKTCAGCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O3/c26-20(15-28-17-11-5-2-6-12-17)24-25-21(16-9-3-1-4-10-16)23-19-14-8-7-13-18(19)22(25)27/h1-14,21,23H,15H2,(H,24,26).
What are the key properties of N-(4-oxo-2-phenyl-1,2-dihydroquinazolin-3-yl)-2-phenoxyacetamide?
N-(4-oxo-2-phenyl-1,2-dihydroquinazolin-3-yl)-2-phenoxyacetamide has a molecular weight of 373.41 g/mol, XLogP of 3.36, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-oxo-2-phenyl-1,2-dihydroquinazolin-3-yl)-2-phenoxyacetamide is sourced from PubChem (CID 18886893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).