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

C13H16N2O — CID 117308300

IUPAC4-(2,3,4,5-tetramethylphenyl)-1,2-oxazol-5-amine
SMILESCc1cc(-c2cnoc2N)c(C)c(C)c1C
InChIInChI=1S/C13H16N2O/c1-7-5-11(10(4)9(3)8(7)2)12-6-15-16-13(12)14/h5-6H,14H2,1-4H3
InChIKeyGMDCNVUXGZHGGC-UHFFFAOYSA-N
MW216.28 g/mol
LogP3.16
Rot. Bonds1

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

4-(2,3,4,5-tetramethylphenyl)-1,2-oxazol-5-amine (PubChem CID 117308300) has the molecular formula C13H16N2O and a molecular weight of 216.28 g/mol. Its IUPAC name is 4-(2,3,4,5-tetramethylphenyl)-1,2-oxazol-5-amine.

Molecular Properties

Compound Name4-(2,3,4,5-tetramethylphenyl)-1,2-oxazol-5-amine
PubChem CID117308300
Molecular FormulaC13H16N2O
Molecular Weight216.28 g/mol
Exact Mass216.13
IUPAC Name4-(2,3,4,5-tetramethylphenyl)-1,2-oxazol-5-amine
SMILESCc1cc(-c2cnoc2N)c(C)c(C)c1C
InChIInChI=1S/C13H16N2O/c1-7-5-11(10(4)9(3)8(7)2)12-6-15-16-13(12)14/h5-6H,14H2,1-4H3
InChIKeyGMDCNVUXGZHGGC-UHFFFAOYSA-N
XLogP3.16
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(2,3,4,5-tetramethylphenyl)-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-(3-amino-4,5-dimethylphenyl)-1,2-oxazol-5-amine
CID 115112194
4-(3-chloro-2-fluoro-5,6-dimethylphenyl)-1,2-oxazol-5-amine
CID 117353932
4-[3-(dimethylamino)-4,5-dimethylphenyl]-1,2-oxazol-5-amine
CID 115112238
4-(5-bromo-2-methylphenyl)-1,2-oxazol-5-amine
CID 83548488
3-(5-amino-1,2-oxazol-4-yl)-2,6-dimethylphenol
CID 117292468
4-(3-bromo-2-fluoro-5,6-dimethylphenyl)-1,2-oxazol-5-amine
CID 117458759
4-(5-chloro-4-fluoro-2-methylphenyl)-1,2-oxazol-5-amine
CID 117325905
3-(5-amino-1,2-oxazol-4-yl)-6-methylbenzene-1,2-diol
CID 117294489
4-(6,7-dimethyl-2,3-dihydro-1,4-benzodioxin-5-yl)-1,2-oxazol-5-amine
CID 117367649
4-(2,3-difluoro-5-methylphenyl)-1,2-oxazol-5-amine
CID 117299828
4-(8-methylspiro[2,4-dihydro-1,5-benzodioxepine-3,1'-cyclopropane]-7-yl)-1,2-oxazol-5-amine
CID 117433533
4-(3-bromo-4-methylphenyl)-1,2-oxazol-5-amine
CID 117385048

Frequently Asked Questions

What is the IUPAC name of 4-(2,3,4,5-tetramethylphenyl)-1,2-oxazol-5-amine?
The IUPAC name of 4-(2,3,4,5-tetramethylphenyl)-1,2-oxazol-5-amine (CID 117308300) is 4-(2,3,4,5-tetramethylphenyl)-1,2-oxazol-5-amine.
What is the SMILES notation for 4-(2,3,4,5-tetramethylphenyl)-1,2-oxazol-5-amine?
The canonical SMILES for 4-(2,3,4,5-tetramethylphenyl)-1,2-oxazol-5-amine is Cc1cc(-c2cnoc2N)c(C)c(C)c1C.
What is the InChIKey of 4-(2,3,4,5-tetramethylphenyl)-1,2-oxazol-5-amine?
The InChIKey is GMDCNVUXGZHGGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O/c1-7-5-11(10(4)9(3)8(7)2)12-6-15-16-13(12)14/h5-6H,14H2,1-4H3.
What are the key properties of 4-(2,3,4,5-tetramethylphenyl)-1,2-oxazol-5-amine?
4-(2,3,4,5-tetramethylphenyl)-1,2-oxazol-5-amine has a molecular weight of 216.28 g/mol, XLogP of 3.16, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3,4,5-tetramethylphenyl)-1,2-oxazol-5-amine is sourced from PubChem (CID 117308300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).