5-methyl-N-(2-phenylquinazolin-4-yl)-1,2-oxazol-3-amine

C18H14N4O — CID 10017795

IUPAC5-methyl-N-(2-phenylquinazolin-4-yl)-1,2-oxazol-3-amine
SMILESCc1cc(Nc2nc(-c3ccccc3)nc3ccccc23)no1
InChIInChI=1S/C18H14N4O/c1-12-11-16(22-23-12)20-18-14-9-5-6-10-15(14)19-17(21-18)13-7-3-2-4-8-13/h2-11H,1H3,(H,19,20,21,22)
InChIKeyPFZCLFYAOOWJHH-UHFFFAOYSA-N
MW302.34 g/mol
LogP4.34
Rot. Bonds3

About 5-methyl-N-(2-phenylquinazolin-4-yl)-1,2-oxazol-3-amine

5-methyl-N-(2-phenylquinazolin-4-yl)-1,2-oxazol-3-amine (PubChem CID 10017795) has the molecular formula C18H14N4O and a molecular weight of 302.34 g/mol. Its IUPAC name is 5-methyl-N-(2-phenylquinazolin-4-yl)-1,2-oxazol-3-amine.

Molecular Properties

Compound Name5-methyl-N-(2-phenylquinazolin-4-yl)-1,2-oxazol-3-amine
PubChem CID10017795
Molecular FormulaC18H14N4O
Molecular Weight302.34 g/mol
Exact Mass302.12
IUPAC Name5-methyl-N-(2-phenylquinazolin-4-yl)-1,2-oxazol-3-amine
SMILESCc1cc(Nc2nc(-c3ccccc3)nc3ccccc23)no1
InChIInChI=1S/C18H14N4O/c1-12-11-16(22-23-12)20-18-14-9-5-6-10-15(14)19-17(21-18)13-7-3-2-4-8-13/h2-11H,1H3,(H,19,20,21,22)
InChIKeyPFZCLFYAOOWJHH-UHFFFAOYSA-N
XLogP4.34
TPSA63.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.34
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-methyl-N-(2-phenylquinazolin-4-yl)-1,2-oxazol-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(2-phenylquinazolin-4-yl)-1,2-oxazol-3-amine?
The IUPAC name of 5-methyl-N-(2-phenylquinazolin-4-yl)-1,2-oxazol-3-amine (CID 10017795) is 5-methyl-N-(2-phenylquinazolin-4-yl)-1,2-oxazol-3-amine.
What is the SMILES notation for 5-methyl-N-(2-phenylquinazolin-4-yl)-1,2-oxazol-3-amine?
The canonical SMILES for 5-methyl-N-(2-phenylquinazolin-4-yl)-1,2-oxazol-3-amine is Cc1cc(Nc2nc(-c3ccccc3)nc3ccccc23)no1.
What is the InChIKey of 5-methyl-N-(2-phenylquinazolin-4-yl)-1,2-oxazol-3-amine?
The InChIKey is PFZCLFYAOOWJHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N4O/c1-12-11-16(22-23-12)20-18-14-9-5-6-10-15(14)19-17(21-18)13-7-3-2-4-8-13/h2-11H,1H3,(H,19,20,21,22).
What are the key properties of 5-methyl-N-(2-phenylquinazolin-4-yl)-1,2-oxazol-3-amine?
5-methyl-N-(2-phenylquinazolin-4-yl)-1,2-oxazol-3-amine has a molecular weight of 302.34 g/mol, XLogP of 4.34, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(2-phenylquinazolin-4-yl)-1,2-oxazol-3-amine is sourced from PubChem (CID 10017795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).