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

C17H16N2O — CID 66205199

IUPAC4-(2-methylphenyl)-5-(3-methylphenyl)-1,2-oxazol-3-amine
SMILESCc1cccc(-c2onc(N)c2-c2ccccc2C)c1
InChIInChI=1S/C17H16N2O/c1-11-6-5-8-13(10-11)16-15(17(18)19-20-16)14-9-4-3-7-12(14)2/h3-10H,1-2H3,(H2,18,19)
InChIKeyRKQDCDIEMJOGHM-UHFFFAOYSA-N
MW264.33 g/mol
LogP4.21
Rot. Bonds2

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

4-(2-methylphenyl)-5-(3-methylphenyl)-1,2-oxazol-3-amine (PubChem CID 66205199) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is 4-(2-methylphenyl)-5-(3-methylphenyl)-1,2-oxazol-3-amine.

Molecular Properties

Compound Name4-(2-methylphenyl)-5-(3-methylphenyl)-1,2-oxazol-3-amine
PubChem CID66205199
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC Name4-(2-methylphenyl)-5-(3-methylphenyl)-1,2-oxazol-3-amine
SMILESCc1cccc(-c2onc(N)c2-c2ccccc2C)c1
InChIInChI=1S/C17H16N2O/c1-11-6-5-8-13(10-11)16-15(17(18)19-20-16)14-9-4-3-7-12(14)2/h3-10H,1-2H3,(H2,18,19)
InChIKeyRKQDCDIEMJOGHM-UHFFFAOYSA-N
XLogP4.21
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2-methylphenyl)-5-phenyl-1,2-oxazol-3-amine
CID 66204991
4-(2-fluorophenyl)-5-(3-methylphenyl)-1,2-oxazol-3-amine
CID 66199355
4-(3-methylphenyl)-5-(4-methylphenyl)-1,2-oxazol-3-amine
CID 66197888
5-(3,5-dimethylphenyl)-4-(3-methylphenyl)-1,2-oxazol-3-amine
CID 66198077
4-(2,4-dichlorophenyl)-5-(3-methylphenyl)-1,2-oxazol-3-amine
CID 66200150
5-(4-iodophenyl)-4-(2-methylphenyl)-1,2-oxazol-3-amine
CID 66205001
5-(3-chloro-4-fluorophenyl)-4-(2-methylphenyl)-1,2-oxazol-3-amine
CID 82878281
5-(furan-3-yl)-4-(2-methylphenyl)-1,2-oxazol-3-amine
CID 66205205
5-(2,3-difluorophenyl)-4-(2-methylphenyl)-1,2-oxazol-3-amine
CID 66198096
4-(2-chlorophenyl)-5-(3,5-dimethylphenyl)-1,2-oxazol-3-amine
CID 66207019
5-(2-methylfuran-3-yl)-4-(2-methylphenyl)-1,2-oxazol-3-amine
CID 66204587
4-(3,4-dimethylphenyl)-5-(2-methylphenyl)-1,2-oxazol-3-amine
CID 66201119

Frequently Asked Questions

What is the IUPAC name of 4-(2-methylphenyl)-5-(3-methylphenyl)-1,2-oxazol-3-amine?
The IUPAC name of 4-(2-methylphenyl)-5-(3-methylphenyl)-1,2-oxazol-3-amine (CID 66205199) is 4-(2-methylphenyl)-5-(3-methylphenyl)-1,2-oxazol-3-amine.
What is the SMILES notation for 4-(2-methylphenyl)-5-(3-methylphenyl)-1,2-oxazol-3-amine?
The canonical SMILES for 4-(2-methylphenyl)-5-(3-methylphenyl)-1,2-oxazol-3-amine is Cc1cccc(-c2onc(N)c2-c2ccccc2C)c1.
What is the InChIKey of 4-(2-methylphenyl)-5-(3-methylphenyl)-1,2-oxazol-3-amine?
The InChIKey is RKQDCDIEMJOGHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O/c1-11-6-5-8-13(10-11)16-15(17(18)19-20-16)14-9-4-3-7-12(14)2/h3-10H,1-2H3,(H2,18,19).
What are the key properties of 4-(2-methylphenyl)-5-(3-methylphenyl)-1,2-oxazol-3-amine?
4-(2-methylphenyl)-5-(3-methylphenyl)-1,2-oxazol-3-amine has a molecular weight of 264.33 g/mol, XLogP of 4.21, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylphenyl)-5-(3-methylphenyl)-1,2-oxazol-3-amine is sourced from PubChem (CID 66205199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).