3-(2-methyl-4-pyridinyl)-4-phenyl-1,2-oxazol-5-amine

C15H13N3O — CID 106753190

IUPAC3-(2-methyl-4-pyridinyl)-4-phenyl-1,2-oxazol-5-amine
SMILESCc1cc(-c2noc(N)c2-c2ccccc2)ccn1
InChIInChI=1S/C15H13N3O/c1-10-9-12(7-8-17-10)14-13(15(16)19-18-14)11-5-3-2-4-6-11/h2-9H,16H2,1H3
InChIKeyPJXLFXQYQQVTPE-UHFFFAOYSA-N
MW251.29 g/mol
LogP3.29
Rot. Bonds2

About 3-(2-methyl-4-pyridinyl)-4-phenyl-1,2-oxazol-5-amine

3-(2-methyl-4-pyridinyl)-4-phenyl-1,2-oxazol-5-amine (PubChem CID 106753190) has the molecular formula C15H13N3O and a molecular weight of 251.29 g/mol. Its IUPAC name is 3-(2-methyl-4-pyridinyl)-4-phenyl-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3-(2-methyl-4-pyridinyl)-4-phenyl-1,2-oxazol-5-amine
PubChem CID106753190
Molecular FormulaC15H13N3O
Molecular Weight251.29 g/mol
Exact Mass251.11
IUPAC Name3-(2-methyl-4-pyridinyl)-4-phenyl-1,2-oxazol-5-amine
SMILESCc1cc(-c2noc(N)c2-c2ccccc2)ccn1
InChIInChI=1S/C15H13N3O/c1-10-9-12(7-8-17-10)14-13(15(16)19-18-14)11-5-3-2-4-6-11/h2-9H,16H2,1H3
InChIKeyPJXLFXQYQQVTPE-UHFFFAOYSA-N
XLogP3.29
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(3,4-dichlorophenyl)-3-(2-methyl-4-pyridinyl)-1,2-oxazol-5-amine
CID 106753207
4-(2,4-dichlorophenyl)-3-(2-methyl-4-pyridinyl)-1,2-oxazol-5-amine
CID 106753195
3-(4-phenylphenyl)-4-pyridin-4-yl-1,2-oxazol-5-amine
CID 69006280
4-(3-methylphenyl)-3-phenyl-1,2-oxazol-5-amine
CID 62829774
4-phenyl-3-pyridazin-4-yl-1,2-oxazol-5-amine
CID 113439303
3-(3,5-difluorophenyl)-4-phenyl-1,2-oxazol-5-amine
CID 43335733
3-(5-methylfuran-2-yl)-4-phenyl-1,2-oxazol-5-amine
CID 43158036
3-(4-bromo-3-chlorophenyl)-4-phenyl-1,2-oxazol-5-amine
CID 81294873
4-(3,5-difluorophenyl)-3-phenyl-1,2-oxazol-5-amine
CID 61496302
3-(4-fluoro-3-methylphenyl)-4-pyridin-4-yl-1,2-oxazol-5-amine
CID 57417818
3-(3,5-dimethylphenyl)-4-(4-methylphenyl)-1,2-oxazol-5-amine
CID 62830488
iodomethane;2-methyl-4-phenylpyridine
CID 143719183

Frequently Asked Questions

What is the IUPAC name of 3-(2-methyl-4-pyridinyl)-4-phenyl-1,2-oxazol-5-amine?
The IUPAC name of 3-(2-methyl-4-pyridinyl)-4-phenyl-1,2-oxazol-5-amine (CID 106753190) is 3-(2-methyl-4-pyridinyl)-4-phenyl-1,2-oxazol-5-amine.
What is the SMILES notation for 3-(2-methyl-4-pyridinyl)-4-phenyl-1,2-oxazol-5-amine?
The canonical SMILES for 3-(2-methyl-4-pyridinyl)-4-phenyl-1,2-oxazol-5-amine is Cc1cc(-c2noc(N)c2-c2ccccc2)ccn1.
What is the InChIKey of 3-(2-methyl-4-pyridinyl)-4-phenyl-1,2-oxazol-5-amine?
The InChIKey is PJXLFXQYQQVTPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O/c1-10-9-12(7-8-17-10)14-13(15(16)19-18-14)11-5-3-2-4-6-11/h2-9H,16H2,1H3.
What are the key properties of 3-(2-methyl-4-pyridinyl)-4-phenyl-1,2-oxazol-5-amine?
3-(2-methyl-4-pyridinyl)-4-phenyl-1,2-oxazol-5-amine has a molecular weight of 251.29 g/mol, XLogP of 3.29, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methyl-4-pyridinyl)-4-phenyl-1,2-oxazol-5-amine is sourced from PubChem (CID 106753190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).