4-(3-methoxy-4-methylphenyl)-3-phenyl-1,2-oxazol-5-amine

C17H16N2O2 — CID 43336126

IUPAC4-(3-methoxy-4-methylphenyl)-3-phenyl-1,2-oxazol-5-amine
SMILESCOc1cc(-c2c(-c3ccccc3)noc2N)ccc1C
InChIInChI=1S/C17H16N2O2/c1-11-8-9-13(10-14(11)20-2)15-16(19-21-17(15)18)12-6-4-3-5-7-12/h3-10H,18H2,1-2H3
InChIKeyRHXHOJJFVDLBLP-UHFFFAOYSA-N
MW280.33 g/mol
LogP3.91
Rot. Bonds3

About 4-(3-methoxy-4-methylphenyl)-3-phenyl-1,2-oxazol-5-amine

4-(3-methoxy-4-methylphenyl)-3-phenyl-1,2-oxazol-5-amine (PubChem CID 43336126) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is 4-(3-methoxy-4-methylphenyl)-3-phenyl-1,2-oxazol-5-amine.

Molecular Properties

Compound Name4-(3-methoxy-4-methylphenyl)-3-phenyl-1,2-oxazol-5-amine
PubChem CID43336126
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC Name4-(3-methoxy-4-methylphenyl)-3-phenyl-1,2-oxazol-5-amine
SMILESCOc1cc(-c2c(-c3ccccc3)noc2N)ccc1C
InChIInChI=1S/C17H16N2O2/c1-11-8-9-13(10-14(11)20-2)15-16(19-21-17(15)18)12-6-4-3-5-7-12/h3-10H,18H2,1-2H3
InChIKeyRHXHOJJFVDLBLP-UHFFFAOYSA-N
XLogP3.91
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(3-methoxy-4-methylphenyl)-3-phenyl-1,2-oxazol-5-amine with MolForge

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

Launch Full Analysis

Related Compounds

4-(3-methoxy-4-methylphenyl)-3-(2-methylfuran-3-yl)-1,2-oxazol-5-amine
CID 43336125
4-(3-methoxy-4-methylphenyl)-3-(4-methylthiophen-3-yl)-1,2-oxazol-5-amine
CID 79802919
4-(3-methylphenyl)-3-phenyl-1,2-oxazol-5-amine
CID 62829774
3-(2,2-dimethylpropyl)-4-(3-methoxy-4-methylphenyl)-1,2-oxazol-5-amine
CID 43158422
3-(3-methoxyphenyl)-4-(3-methylphenyl)-1,2-oxazol-5-amine
CID 62829950
4-(3,5-difluorophenyl)-3-phenyl-1,2-oxazol-5-amine
CID 61496302
4-(4-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)-1,2-oxazol-5-amine
CID 46227182
4-(4-methoxy-3-methylphenyl)-3-methyl-1,2-oxazol-5-amine
CID 82079241
3-(4-chlorophenyl)-4-(3-methylphenyl)-1,2-oxazol-5-amine
CID 62829610
3-(4-fluorophenyl)-4-(3-methylphenyl)-1,2-oxazol-5-amine
CID 62829957
3-(3-iodophenyl)-4-(3-methoxyphenyl)-1,2-oxazol-5-amine
CID 61263311
3-(3-bromophenyl)-4-(3-methoxyphenyl)-1,2-oxazol-5-amine
CID 61261442

Frequently Asked Questions

What is the IUPAC name of 4-(3-methoxy-4-methylphenyl)-3-phenyl-1,2-oxazol-5-amine?
The IUPAC name of 4-(3-methoxy-4-methylphenyl)-3-phenyl-1,2-oxazol-5-amine (CID 43336126) is 4-(3-methoxy-4-methylphenyl)-3-phenyl-1,2-oxazol-5-amine.
What is the SMILES notation for 4-(3-methoxy-4-methylphenyl)-3-phenyl-1,2-oxazol-5-amine?
The canonical SMILES for 4-(3-methoxy-4-methylphenyl)-3-phenyl-1,2-oxazol-5-amine is COc1cc(-c2c(-c3ccccc3)noc2N)ccc1C.
What is the InChIKey of 4-(3-methoxy-4-methylphenyl)-3-phenyl-1,2-oxazol-5-amine?
The InChIKey is RHXHOJJFVDLBLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c1-11-8-9-13(10-14(11)20-2)15-16(19-21-17(15)18)12-6-4-3-5-7-12/h3-10H,18H2,1-2H3.
What are the key properties of 4-(3-methoxy-4-methylphenyl)-3-phenyl-1,2-oxazol-5-amine?
4-(3-methoxy-4-methylphenyl)-3-phenyl-1,2-oxazol-5-amine has a molecular weight of 280.33 g/mol, XLogP of 3.91, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methoxy-4-methylphenyl)-3-phenyl-1,2-oxazol-5-amine is sourced from PubChem (CID 43336126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).