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

C15H12FN3O — CID 80522275

IUPAC5-(3-fluoro-4-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine
SMILESCc1ccc(-c2onc(N)c2-c2ccccn2)cc1F
InChIInChI=1S/C15H12FN3O/c1-9-5-6-10(8-11(9)16)14-13(15(17)19-20-14)12-4-2-3-7-18-12/h2-8H,1H3,(H2,17,19)
InChIKeyCVPWMWIXUQHESF-UHFFFAOYSA-N
MW269.28 g/mol
LogP3.43
Rot. Bonds2

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

5-(3-fluoro-4-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine (PubChem CID 80522275) has the molecular formula C15H12FN3O and a molecular weight of 269.28 g/mol. Its IUPAC name is 5-(3-fluoro-4-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine.

Molecular Properties

Compound Name5-(3-fluoro-4-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine
PubChem CID80522275
Molecular FormulaC15H12FN3O
Molecular Weight269.28 g/mol
Exact Mass269.10
IUPAC Name5-(3-fluoro-4-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine
SMILESCc1ccc(-c2onc(N)c2-c2ccccn2)cc1F
InChIInChI=1S/C15H12FN3O/c1-9-5-6-10(8-11(9)16)14-13(15(17)19-20-14)12-4-2-3-7-18-12/h2-8H,1H3,(H2,17,19)
InChIKeyCVPWMWIXUQHESF-UHFFFAOYSA-N
XLogP3.43
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.28
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(3-chloro-4-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine
CID 80522847
4-(3,5-difluorophenyl)-5-pyridin-2-yl-1,2-oxazol-3-amine
CID 66201880
5-(3,5-dichlorophenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine
CID 80521472
5-(4-bromo-3-chlorophenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine
CID 81307029
5-(3-chloro-4-iodophenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine
CID 103222608
5-(3,4-dimethylphenyl)-4-(2-fluorophenyl)-1,2-oxazol-3-amine
CID 66200765
5-(2-fluoro-4-methoxyphenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine
CID 102885745
5-(2,3-dimethylphenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine
CID 80521578
5-(3-amino-4-pyridin-2-yl-1,2-oxazol-5-yl)-1H-pyridin-2-one
CID 136742866
5-(3-chloro-4-fluorophenyl)-4-(2-methylphenyl)-1,2-oxazol-3-amine
CID 82878281
5-(3,4-difluorophenyl)-4-(3-fluorophenyl)-1,2-oxazol-3-amine
CID 66198579
5-(4-chloro-2-methoxyphenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine
CID 80521231

Frequently Asked Questions

What is the IUPAC name of 5-(3-fluoro-4-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine?
The IUPAC name of 5-(3-fluoro-4-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine (CID 80522275) is 5-(3-fluoro-4-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine.
What is the SMILES notation for 5-(3-fluoro-4-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine?
The canonical SMILES for 5-(3-fluoro-4-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine is Cc1ccc(-c2onc(N)c2-c2ccccn2)cc1F.
What is the InChIKey of 5-(3-fluoro-4-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine?
The InChIKey is CVPWMWIXUQHESF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FN3O/c1-9-5-6-10(8-11(9)16)14-13(15(17)19-20-14)12-4-2-3-7-18-12/h2-8H,1H3,(H2,17,19).
What are the key properties of 5-(3-fluoro-4-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine?
5-(3-fluoro-4-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine has a molecular weight of 269.28 g/mol, XLogP of 3.43, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-fluoro-4-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine is sourced from PubChem (CID 80522275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).