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

C15H12ClN3O — CID 81323738

IUPAC3-(3-chloro-5-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-5-amine
SMILESCc1cc(Cl)cc(-c2noc(N)c2-c2ccccn2)c1
InChIInChI=1S/C15H12ClN3O/c1-9-6-10(8-11(16)7-9)14-13(15(17)20-19-14)12-4-2-3-5-18-12/h2-8H,17H2,1H3
InChIKeyLEYNAHGCQGEJAI-UHFFFAOYSA-N
MW285.73 g/mol
LogP3.95
Rot. Bonds2

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

3-(3-chloro-5-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-5-amine (PubChem CID 81323738) has the molecular formula C15H12ClN3O and a molecular weight of 285.73 g/mol. Its IUPAC name is 3-(3-chloro-5-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3-(3-chloro-5-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-5-amine
PubChem CID81323738
Molecular FormulaC15H12ClN3O
Molecular Weight285.73 g/mol
Exact Mass285.07
IUPAC Name3-(3-chloro-5-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-5-amine
SMILESCc1cc(Cl)cc(-c2noc(N)c2-c2ccccn2)c1
InChIInChI=1S/C15H12ClN3O/c1-9-6-10(8-11(16)7-9)14-13(15(17)20-19-14)12-4-2-3-5-18-12/h2-8H,17H2,1H3
InChIKeyLEYNAHGCQGEJAI-UHFFFAOYSA-N
XLogP3.95
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.73
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(3-chloro-5-methylphenyl)-4-pyridin-2-yl-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-pyridin-2-yl-3-(2,4,6-trimethylphenyl)-1,2-oxazol-5-amine
CID 80521077
3-(3-chloro-5-methylphenyl)-4-(3-chlorophenyl)-1,2-oxazol-5-amine
CID 81316062
4-(2-bromophenyl)-3-(3-chloro-5-methylphenyl)-1,2-oxazol-5-amine
CID 81317351
3-(furan-3-yl)-4-pyridin-2-yl-1,2-oxazol-5-amine
CID 80521431
3-(4,5-dimethylthiophen-2-yl)-4-pyridin-2-yl-1,2-oxazol-5-amine
CID 80521630
3-(3,5-dimethylphenyl)-4-(4-methylphenyl)-1,2-oxazol-5-amine
CID 62830488
3-(5-bromo-2-chlorophenyl)-4-pyridin-2-yl-1,2-oxazol-5-amine
CID 80521611
3-(4-chloro-2,5-difluorophenyl)-4-pyridin-2-yl-1,2-oxazol-5-amine
CID 82772619
3-(4-chlorophenyl)-4-(3-methylphenyl)-1,2-oxazol-5-amine
CID 62829610
5-(3,5-dichlorophenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine
CID 80521472
2-[3-[3-(3,5-dipyridin-2-ylphenyl)-5-methylphenyl]-5-pyridin-2-ylphenyl]pyridine
CID 58556429
4-(3-methylphenyl)-3-phenyl-1,2-oxazol-5-amine
CID 62829774

Frequently Asked Questions

What is the IUPAC name of 3-(3-chloro-5-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-5-amine?
The IUPAC name of 3-(3-chloro-5-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-5-amine (CID 81323738) is 3-(3-chloro-5-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-5-amine.
What is the SMILES notation for 3-(3-chloro-5-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-5-amine?
The canonical SMILES for 3-(3-chloro-5-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-5-amine is Cc1cc(Cl)cc(-c2noc(N)c2-c2ccccn2)c1.
What is the InChIKey of 3-(3-chloro-5-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-5-amine?
The InChIKey is LEYNAHGCQGEJAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN3O/c1-9-6-10(8-11(16)7-9)14-13(15(17)20-19-14)12-4-2-3-5-18-12/h2-8H,17H2,1H3.
What are the key properties of 3-(3-chloro-5-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-5-amine?
3-(3-chloro-5-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-5-amine has a molecular weight of 285.73 g/mol, XLogP of 3.95, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-chloro-5-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-5-amine is sourced from PubChem (CID 81323738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).