N-[4-(4-phenylquinazolin-2-yl)phenyl]acetamide

C22H17N3O — CID 4523406

IUPACN-[4-(4-phenylquinazolin-2-yl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(-c2nc(-c3ccccc3)c3ccccc3n2)cc1
InChIInChI=1S/C22H17N3O/c1-15(26)23-18-13-11-17(12-14-18)22-24-20-10-6-5-9-19(20)21(25-22)16-7-3-2-4-8-16/h2-14H,1H3,(H,23,26)
InChIKeyFBOJAAGTLKDNRE-UHFFFAOYSA-N
MW339.40 g/mol
LogP4.92
Rot. Bonds3

About N-[4-(4-phenylquinazolin-2-yl)phenyl]acetamide

N-[4-(4-phenylquinazolin-2-yl)phenyl]acetamide (PubChem CID 4523406) has the molecular formula C22H17N3O and a molecular weight of 339.40 g/mol. Its IUPAC name is N-[4-(4-phenylquinazolin-2-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-[4-(4-phenylquinazolin-2-yl)phenyl]acetamide
PubChem CID4523406
Molecular FormulaC22H17N3O
Molecular Weight339.40 g/mol
Exact Mass339.14
IUPAC NameN-[4-(4-phenylquinazolin-2-yl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(-c2nc(-c3ccccc3)c3ccccc3n2)cc1
InChIInChI=1S/C22H17N3O/c1-15(26)23-18-13-11-17(12-14-18)22-24-20-10-6-5-9-19(20)21(25-22)16-7-3-2-4-8-16/h2-14H,1H3,(H,23,26)
InChIKeyFBOJAAGTLKDNRE-UHFFFAOYSA-N
XLogP4.92
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[4-(4-phenylquinazolin-2-yl)phenyl]acetamide?
The IUPAC name of N-[4-(4-phenylquinazolin-2-yl)phenyl]acetamide (CID 4523406) is N-[4-(4-phenylquinazolin-2-yl)phenyl]acetamide.
What is the SMILES notation for N-[4-(4-phenylquinazolin-2-yl)phenyl]acetamide?
The canonical SMILES for N-[4-(4-phenylquinazolin-2-yl)phenyl]acetamide is CC(=O)Nc1ccc(-c2nc(-c3ccccc3)c3ccccc3n2)cc1.
What is the InChIKey of N-[4-(4-phenylquinazolin-2-yl)phenyl]acetamide?
The InChIKey is FBOJAAGTLKDNRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N3O/c1-15(26)23-18-13-11-17(12-14-18)22-24-20-10-6-5-9-19(20)21(25-22)16-7-3-2-4-8-16/h2-14H,1H3,(H,23,26).
What are the key properties of N-[4-(4-phenylquinazolin-2-yl)phenyl]acetamide?
N-[4-(4-phenylquinazolin-2-yl)phenyl]acetamide has a molecular weight of 339.40 g/mol, XLogP of 4.92, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-phenylquinazolin-2-yl)phenyl]acetamide is sourced from PubChem (CID 4523406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).