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

C17H16N2O2 — CID 62829950

IUPAC3-(3-methoxyphenyl)-4-(3-methylphenyl)-1,2-oxazol-5-amine
SMILESCOc1cccc(-c2noc(N)c2-c2cccc(C)c2)c1
InChIInChI=1S/C17H16N2O2/c1-11-5-3-6-12(9-11)15-16(19-21-17(15)18)13-7-4-8-14(10-13)20-2/h3-10H,18H2,1-2H3
InChIKeyDZYFMOBHYYNJPD-UHFFFAOYSA-N
MW280.33 g/mol
LogP3.91
Rot. Bonds3

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

3-(3-methoxyphenyl)-4-(3-methylphenyl)-1,2-oxazol-5-amine (PubChem CID 62829950) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is 3-(3-methoxyphenyl)-4-(3-methylphenyl)-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3-(3-methoxyphenyl)-4-(3-methylphenyl)-1,2-oxazol-5-amine
PubChem CID62829950
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC Name3-(3-methoxyphenyl)-4-(3-methylphenyl)-1,2-oxazol-5-amine
SMILESCOc1cccc(-c2noc(N)c2-c2cccc(C)c2)c1
InChIInChI=1S/C17H16N2O2/c1-11-5-3-6-12(9-11)15-16(19-21-17(15)18)13-7-4-8-14(10-13)20-2/h3-10H,18H2,1-2H3
InChIKeyDZYFMOBHYYNJPD-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

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Related Compounds

3-(3-bromophenyl)-4-(3-methoxyphenyl)-1,2-oxazol-5-amine
CID 61261442
3-(3-iodophenyl)-4-(3-methoxyphenyl)-1,2-oxazol-5-amine
CID 61263311
4-(3-methylphenyl)-3-phenyl-1,2-oxazol-5-amine
CID 62829774
3-(4-methoxythiophen-2-yl)-4-(3-methylphenyl)-1,2-oxazol-5-amine
CID 81121251
3-(3-methoxyphenyl)-4-thiophen-2-yl-1,2-oxazol-5-amine
CID 55079639
3-(4-fluorophenyl)-4-(3-methylphenyl)-1,2-oxazol-5-amine
CID 62829957
3-(4-chlorophenyl)-4-(3-methylphenyl)-1,2-oxazol-5-amine
CID 62829610
4-(3-methoxyphenyl)-3-(1-methylpyrazol-3-yl)-1,2-oxazol-5-amine
CID 103119565
3-(5-bromofuran-2-yl)-4-(3-methoxyphenyl)-1,2-oxazol-5-amine
CID 61261819
3-(3-chlorothiophen-2-yl)-4-(3-methoxyphenyl)-1,2-oxazol-5-amine
CID 80644237
3-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-5-amine
CID 62828557
4-(3-methoxy-4-methylphenyl)-3-phenyl-1,2-oxazol-5-amine
CID 43336126

Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxyphenyl)-4-(3-methylphenyl)-1,2-oxazol-5-amine?
The IUPAC name of 3-(3-methoxyphenyl)-4-(3-methylphenyl)-1,2-oxazol-5-amine (CID 62829950) is 3-(3-methoxyphenyl)-4-(3-methylphenyl)-1,2-oxazol-5-amine.
What is the SMILES notation for 3-(3-methoxyphenyl)-4-(3-methylphenyl)-1,2-oxazol-5-amine?
The canonical SMILES for 3-(3-methoxyphenyl)-4-(3-methylphenyl)-1,2-oxazol-5-amine is COc1cccc(-c2noc(N)c2-c2cccc(C)c2)c1.
What is the InChIKey of 3-(3-methoxyphenyl)-4-(3-methylphenyl)-1,2-oxazol-5-amine?
The InChIKey is DZYFMOBHYYNJPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c1-11-5-3-6-12(9-11)15-16(19-21-17(15)18)13-7-4-8-14(10-13)20-2/h3-10H,18H2,1-2H3.
What are the key properties of 3-(3-methoxyphenyl)-4-(3-methylphenyl)-1,2-oxazol-5-amine?
3-(3-methoxyphenyl)-4-(3-methylphenyl)-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 3-(3-methoxyphenyl)-4-(3-methylphenyl)-1,2-oxazol-5-amine is sourced from PubChem (CID 62829950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).