3-(2,3-dimethylphenyl)-4-pyridin-3-yl-1,2-oxazol-5-amine

C16H15N3O — CID 80523111

IUPAC3-(2,3-dimethylphenyl)-4-pyridin-3-yl-1,2-oxazol-5-amine
SMILESCc1cccc(-c2noc(N)c2-c2cccnc2)c1C
InChIInChI=1S/C16H15N3O/c1-10-5-3-7-13(11(10)2)15-14(16(17)20-19-15)12-6-4-8-18-9-12/h3-9H,17H2,1-2H3
InChIKeyGGMJYJUKSRPPOC-UHFFFAOYSA-N
MW265.32 g/mol
LogP3.60
Rot. Bonds2

About 3-(2,3-dimethylphenyl)-4-pyridin-3-yl-1,2-oxazol-5-amine

3-(2,3-dimethylphenyl)-4-pyridin-3-yl-1,2-oxazol-5-amine (PubChem CID 80523111) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is 3-(2,3-dimethylphenyl)-4-pyridin-3-yl-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3-(2,3-dimethylphenyl)-4-pyridin-3-yl-1,2-oxazol-5-amine
PubChem CID80523111
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC Name3-(2,3-dimethylphenyl)-4-pyridin-3-yl-1,2-oxazol-5-amine
SMILESCc1cccc(-c2noc(N)c2-c2cccnc2)c1C
InChIInChI=1S/C16H15N3O/c1-10-5-3-7-13(11(10)2)15-14(16(17)20-19-15)12-6-4-8-18-9-12/h3-9H,17H2,1-2H3
InChIKeyGGMJYJUKSRPPOC-UHFFFAOYSA-N
XLogP3.60
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2-fluoro-3-methylphenyl)-4-pyridin-3-yl-1,2-oxazol-5-amine
CID 81477801
3-(4-bromo-2-methylphenyl)-4-pyridin-3-yl-1,2-oxazol-5-amine
CID 80523150
3-(2-methylsulfanylphenyl)-4-pyridin-3-yl-1,2-oxazol-5-amine
CID 80523025
3-(2-methoxy-5-methylphenyl)-4-pyridin-3-yl-1,2-oxazol-5-amine
CID 80522526
3-(4-methylsulfanylphenyl)-4-pyridin-3-yl-1,2-oxazol-5-amine
CID 80522903
4-(3-bromophenyl)-3-(2-methylphenyl)-1,2-oxazol-5-amine
CID 43560913
3-(5-bromo-2-chlorophenyl)-4-pyridin-3-yl-1,2-oxazol-5-amine
CID 80523152
3-ethyl-4-pyridin-3-yl-1,2-oxazol-5-amine
CID 80523163
3-(4-bromo-2-fluorophenyl)-4-pyridin-3-yl-1,2-oxazol-5-amine
CID 80522997
3-methyl-2-pyridin-3-ylaniline
CID 22482419
4-(3-fluorophenyl)-3-(2-methylphenyl)-1,2-oxazol-5-amine
CID 43336065
3-(2-bromo-3-methylphenyl)-4-(4-methylphenyl)-1,2-oxazol-5-amine
CID 107982879

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dimethylphenyl)-4-pyridin-3-yl-1,2-oxazol-5-amine?
The IUPAC name of 3-(2,3-dimethylphenyl)-4-pyridin-3-yl-1,2-oxazol-5-amine (CID 80523111) is 3-(2,3-dimethylphenyl)-4-pyridin-3-yl-1,2-oxazol-5-amine.
What is the SMILES notation for 3-(2,3-dimethylphenyl)-4-pyridin-3-yl-1,2-oxazol-5-amine?
The canonical SMILES for 3-(2,3-dimethylphenyl)-4-pyridin-3-yl-1,2-oxazol-5-amine is Cc1cccc(-c2noc(N)c2-c2cccnc2)c1C.
What is the InChIKey of 3-(2,3-dimethylphenyl)-4-pyridin-3-yl-1,2-oxazol-5-amine?
The InChIKey is GGMJYJUKSRPPOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c1-10-5-3-7-13(11(10)2)15-14(16(17)20-19-15)12-6-4-8-18-9-12/h3-9H,17H2,1-2H3.
What are the key properties of 3-(2,3-dimethylphenyl)-4-pyridin-3-yl-1,2-oxazol-5-amine?
3-(2,3-dimethylphenyl)-4-pyridin-3-yl-1,2-oxazol-5-amine has a molecular weight of 265.32 g/mol, XLogP of 3.60, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dimethylphenyl)-4-pyridin-3-yl-1,2-oxazol-5-amine is sourced from PubChem (CID 80523111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).