3,4-diphenyl-1,2-oxazol-5-amine

C15H12N2O — CID 1042732

IUPAC3,4-diphenyl-1,2-oxazol-5-amine
SMILESNc1onc(-c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C15H12N2O/c16-15-13(11-7-3-1-4-8-11)14(17-18-15)12-9-5-2-6-10-12/h1-10H,16H2
InChIKeyOJHYWOWFEGPIQA-UHFFFAOYSA-N
MW236.27 g/mol
LogP3.59
Rot. Bonds2

About 3,4-diphenyl-1,2-oxazol-5-amine

3,4-diphenyl-1,2-oxazol-5-amine (PubChem CID 1042732) has the molecular formula C15H12N2O and a molecular weight of 236.27 g/mol. Its IUPAC name is 3,4-diphenyl-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3,4-diphenyl-1,2-oxazol-5-amine
PubChem CID1042732
Molecular FormulaC15H12N2O
Molecular Weight236.27 g/mol
Exact Mass236.09
IUPAC Name3,4-diphenyl-1,2-oxazol-5-amine
SMILESNc1onc(-c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C15H12N2O/c16-15-13(11-7-3-1-4-8-11)14(17-18-15)12-9-5-2-6-10-12/h1-10H,16H2
InChIKeyOJHYWOWFEGPIQA-UHFFFAOYSA-N
XLogP3.59
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-Diphenylisoxazole
CID 137292
3,5-Dimethyl-4-phenylisoxazole
CID 5325760
3-Methyl-4-phenylisoxazol-5-amine
CID 1382046
5-Methyl-3,4-diphenyl-isoxazole
CID 9991673
5-Amino-3-phenylisoxazole
CID 261201
3-(4-Methylphenyl)-1,2-oxazol-5-amine
CID 576446
3,4-Diphenyl-5-ethylisoxazole
CID 10377376
3-p-Tolyl-isoxazole-4,5-dione dioxime
CID 562341
Isoxazole, 5-(4-methylphenyl)-3-phenyl-
CID 296680
3-methyl-N-(3-phenyl-1,2-oxazol-5-yl)benzamide
CID 16445174
N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]benzamide
CID 7693891
3,5-Bis(4-amidinophenyl)isoxazole
CID 439104

Frequently Asked Questions

What is the IUPAC name of 3,4-diphenyl-1,2-oxazol-5-amine?
The IUPAC name of 3,4-diphenyl-1,2-oxazol-5-amine (CID 1042732) is 3,4-diphenyl-1,2-oxazol-5-amine.
What is the SMILES notation for 3,4-diphenyl-1,2-oxazol-5-amine?
The canonical SMILES for 3,4-diphenyl-1,2-oxazol-5-amine is Nc1onc(-c2ccccc2)c1-c1ccccc1.
What is the InChIKey of 3,4-diphenyl-1,2-oxazol-5-amine?
The InChIKey is OJHYWOWFEGPIQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O/c16-15-13(11-7-3-1-4-8-11)14(17-18-15)12-9-5-2-6-10-12/h1-10H,16H2.
What are the key properties of 3,4-diphenyl-1,2-oxazol-5-amine?
3,4-diphenyl-1,2-oxazol-5-amine has a molecular weight of 236.27 g/mol, XLogP of 3.59, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-diphenyl-1,2-oxazol-5-amine is sourced from PubChem (CID 1042732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).