3-(5-amino-1,2-oxazol-4-yl)-2,6-dimethylphenol

C11H12N2O2 — CID 117292468

IUPAC3-(5-amino-1,2-oxazol-4-yl)-2,6-dimethylphenol
SMILESCc1ccc(-c2cnoc2N)c(C)c1O
InChIInChI=1S/C11H12N2O2/c1-6-3-4-8(7(2)10(6)14)9-5-13-15-11(9)12/h3-5,14H,12H2,1-2H3
InChIKeyDQLVOTKLRTYTAN-UHFFFAOYSA-N
MW204.23 g/mol
LogP2.25
Rot. Bonds1

About 3-(5-amino-1,2-oxazol-4-yl)-2,6-dimethylphenol

3-(5-amino-1,2-oxazol-4-yl)-2,6-dimethylphenol (PubChem CID 117292468) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is 3-(5-amino-1,2-oxazol-4-yl)-2,6-dimethylphenol.

Molecular Properties

Compound Name3-(5-amino-1,2-oxazol-4-yl)-2,6-dimethylphenol
PubChem CID117292468
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC Name3-(5-amino-1,2-oxazol-4-yl)-2,6-dimethylphenol
SMILESCc1ccc(-c2cnoc2N)c(C)c1O
InChIInChI=1S/C11H12N2O2/c1-6-3-4-8(7(2)10(6)14)9-5-13-15-11(9)12/h3-5,14H,12H2,1-2H3
InChIKeyDQLVOTKLRTYTAN-UHFFFAOYSA-N
XLogP2.25
TPSA72.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(5-amino-1,2-oxazol-4-yl)-6-methylbenzene-1,2-diol
CID 117294489
4-(2,3,4,5-tetramethylphenyl)-1,2-oxazol-5-amine
CID 117308300
4-(5-amino-1,2-oxazol-4-yl)-2-fluorobenzene-1,3-diol
CID 117299784
4-(5-bromo-2-methylphenyl)-1,2-oxazol-5-amine
CID 83548488
4-(3-methoxy-2-methylphenyl)-1,2-oxazol-5-amine
CID 117292477
4-(5-amino-1,2-oxazol-4-yl)-5,6,7,8-tetrahydronaphthalen-1-ol
CID 117332534
3-(5-amino-1,2-oxazol-4-yl)-2-methylsulfonylphenol
CID 117388686
2-(5-amino-1,2-oxazol-4-yl)-3,5-dimethylphenol
CID 117292479
4-(3-bromo-4-methylphenyl)-1,2-oxazol-5-amine
CID 117385048
3-(5-amino-1,2-oxazol-4-yl)-2-methylsulfanylphenol
CID 117318069
4-(5-amino-1,2-oxazol-4-yl)-2-chloro-3-fluorophenol
CID 117329312
4-(3-amino-4,5-dimethylphenyl)-1,2-oxazol-5-amine
CID 115112194

Frequently Asked Questions

What is the IUPAC name of 3-(5-amino-1,2-oxazol-4-yl)-2,6-dimethylphenol?
The IUPAC name of 3-(5-amino-1,2-oxazol-4-yl)-2,6-dimethylphenol (CID 117292468) is 3-(5-amino-1,2-oxazol-4-yl)-2,6-dimethylphenol.
What is the SMILES notation for 3-(5-amino-1,2-oxazol-4-yl)-2,6-dimethylphenol?
The canonical SMILES for 3-(5-amino-1,2-oxazol-4-yl)-2,6-dimethylphenol is Cc1ccc(-c2cnoc2N)c(C)c1O.
What is the InChIKey of 3-(5-amino-1,2-oxazol-4-yl)-2,6-dimethylphenol?
The InChIKey is DQLVOTKLRTYTAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c1-6-3-4-8(7(2)10(6)14)9-5-13-15-11(9)12/h3-5,14H,12H2,1-2H3.
What are the key properties of 3-(5-amino-1,2-oxazol-4-yl)-2,6-dimethylphenol?
3-(5-amino-1,2-oxazol-4-yl)-2,6-dimethylphenol has a molecular weight of 204.23 g/mol, XLogP of 2.25, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-amino-1,2-oxazol-4-yl)-2,6-dimethylphenol is sourced from PubChem (CID 117292468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).