N-(4-oxoquinazolin-3-yl)-2-(4-phenylphenyl)acetamide

C22H17N3O2 — CID 26181771

IUPACN-(4-oxoquinazolin-3-yl)-2-(4-phenylphenyl)acetamide
SMILESO=C(Cc1ccc(-c2ccccc2)cc1)Nn1cnc2ccccc2c1=O
InChIInChI=1S/C22H17N3O2/c26-21(24-25-15-23-20-9-5-4-8-19(20)22(25)27)14-16-10-12-18(13-11-16)17-6-2-1-3-7-17/h1-13,15H,14H2,(H,24,26)
InChIKeyIHZHDYWBBHFWQO-UHFFFAOYSA-N
MW355.40 g/mol
LogP3.38
Rot. Bonds4

About N-(4-oxoquinazolin-3-yl)-2-(4-phenylphenyl)acetamide

N-(4-oxoquinazolin-3-yl)-2-(4-phenylphenyl)acetamide (PubChem CID 26181771) has the molecular formula C22H17N3O2 and a molecular weight of 355.40 g/mol. Its IUPAC name is N-(4-oxoquinazolin-3-yl)-2-(4-phenylphenyl)acetamide.

Molecular Properties

Compound NameN-(4-oxoquinazolin-3-yl)-2-(4-phenylphenyl)acetamide
PubChem CID26181771
Molecular FormulaC22H17N3O2
Molecular Weight355.40 g/mol
Exact Mass355.13
IUPAC NameN-(4-oxoquinazolin-3-yl)-2-(4-phenylphenyl)acetamide
SMILESO=C(Cc1ccc(-c2ccccc2)cc1)Nn1cnc2ccccc2c1=O
InChIInChI=1S/C22H17N3O2/c26-21(24-25-15-23-20-9-5-4-8-19(20)22(25)27)14-16-10-12-18(13-11-16)17-6-2-1-3-7-17/h1-13,15H,14H2,(H,24,26)
InChIKeyIHZHDYWBBHFWQO-UHFFFAOYSA-N
XLogP3.38
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.40
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-oxoquinazolin-3-yl)-2-(4-phenylphenyl)acetamide?
The IUPAC name of N-(4-oxoquinazolin-3-yl)-2-(4-phenylphenyl)acetamide (CID 26181771) is N-(4-oxoquinazolin-3-yl)-2-(4-phenylphenyl)acetamide.
What is the SMILES notation for N-(4-oxoquinazolin-3-yl)-2-(4-phenylphenyl)acetamide?
The canonical SMILES for N-(4-oxoquinazolin-3-yl)-2-(4-phenylphenyl)acetamide is O=C(Cc1ccc(-c2ccccc2)cc1)Nn1cnc2ccccc2c1=O.
What is the InChIKey of N-(4-oxoquinazolin-3-yl)-2-(4-phenylphenyl)acetamide?
The InChIKey is IHZHDYWBBHFWQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N3O2/c26-21(24-25-15-23-20-9-5-4-8-19(20)22(25)27)14-16-10-12-18(13-11-16)17-6-2-1-3-7-17/h1-13,15H,14H2,(H,24,26).
What are the key properties of N-(4-oxoquinazolin-3-yl)-2-(4-phenylphenyl)acetamide?
N-(4-oxoquinazolin-3-yl)-2-(4-phenylphenyl)acetamide has a molecular weight of 355.40 g/mol, XLogP of 3.38, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-oxoquinazolin-3-yl)-2-(4-phenylphenyl)acetamide is sourced from PubChem (CID 26181771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).