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

C19H16N4O — CID 3234735

IUPAC2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenylquinazolin-4-amine
SMILESCc1noc(C)c1-c1nc(Nc2ccccc2)c2ccccc2n1
InChIInChI=1S/C19H16N4O/c1-12-17(13(2)24-23-12)19-21-16-11-7-6-10-15(16)18(22-19)20-14-8-4-3-5-9-14/h3-11H,1-2H3,(H,20,21,22)
InChIKeyQNBWLYBJMOEHRA-UHFFFAOYSA-N
MW316.36 g/mol
LogP4.65
Rot. Bonds3

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

2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenylquinazolin-4-amine (PubChem CID 3234735) has the molecular formula C19H16N4O and a molecular weight of 316.36 g/mol. Its IUPAC name is 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenylquinazolin-4-amine.

Molecular Properties

Compound Name2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenylquinazolin-4-amine
PubChem CID3234735
Molecular FormulaC19H16N4O
Molecular Weight316.36 g/mol
Exact Mass316.13
IUPAC Name2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenylquinazolin-4-amine
SMILESCc1noc(C)c1-c1nc(Nc2ccccc2)c2ccccc2n1
InChIInChI=1S/C19H16N4O/c1-12-17(13(2)24-23-12)19-21-16-11-7-6-10-15(16)18(22-19)20-14-8-4-3-5-9-14/h3-11H,1-2H3,(H,20,21,22)
InChIKeyQNBWLYBJMOEHRA-UHFFFAOYSA-N
XLogP4.65
TPSA63.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(E)-(3,5-Dimethyl-1,2-oxazol-4-yl)methylideneamino]quinolin-2-amine
CID 9684263
N-[4-[[[6-(3,5-dimethyl-4-isoxazolyl)-4-quinazolinyl]amino]methyl]phenyl]acetamide
CID 17757086
2-(3,5-dimethylisoxazol-4-yl)-N-(3-ethylphenyl)-4-o-tolyl-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-carboxamide
CID 25110840
2-(3,5-dimethyl-1,2-oxazol-4-yl)-5-phenyl-N-(pyridin-2-ylmethyl)quinazolin-4-amine
CID 68204902
N'-[[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methyl-6-phenylazanyl-pyrimidin-2-yl]phenyl]methyl]-N-methyl-ethane-1,2-diamine
CID 146188223
6-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanylmethyl]-2-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine
CID 2576482
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(5-methylpyrazin-2-yl)methyl]quinazolin-4-amine
CID 3233783
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2-methoxyphenyl)methyl]quinazolin-4-amine
CID 3233914
3,5-Dimethyl-4-(4-piperazin-1-ylquinazolin-2-yl)-1,2-oxazole
CID 3233975
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-methylquinazolin-4-amine
CID 3234198
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(2-morpholin-4-ylethyl)quinazolin-4-amine
CID 3234356
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3-methylphenyl)methyl]quinazolin-4-amine
CID 3234437

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenylquinazolin-4-amine?
The IUPAC name of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenylquinazolin-4-amine (CID 3234735) is 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenylquinazolin-4-amine.
What is the SMILES notation for 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenylquinazolin-4-amine?
The canonical SMILES for 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenylquinazolin-4-amine is Cc1noc(C)c1-c1nc(Nc2ccccc2)c2ccccc2n1.
What is the InChIKey of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenylquinazolin-4-amine?
The InChIKey is QNBWLYBJMOEHRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O/c1-12-17(13(2)24-23-12)19-21-16-11-7-6-10-15(16)18(22-19)20-14-8-4-3-5-9-14/h3-11H,1-2H3,(H,20,21,22).
What are the key properties of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenylquinazolin-4-amine?
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenylquinazolin-4-amine has a molecular weight of 316.36 g/mol, XLogP of 4.65, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenylquinazolin-4-amine is sourced from PubChem (CID 3234735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).