2-(3-amino-1,2-oxazol-5-yl)-6-methoxy-3-methylphenol

C11H12N2O3 — CID 136993784

IUPAC2-(3-amino-1,2-oxazol-5-yl)-6-methoxy-3-methylphenol
SMILESCOc1ccc(C)c(-c2cc(N)no2)c1O
InChIInChI=1S/C11H12N2O3/c1-6-3-4-7(15-2)11(14)10(6)8-5-9(12)13-16-8/h3-5,14H,1-2H3,(H2,12,13)
InChIKeyYKQAAMYAJQKFMT-UHFFFAOYSA-N
MW220.23 g/mol
LogP1.95
Rot. Bonds2

About 2-(3-amino-1,2-oxazol-5-yl)-6-methoxy-3-methylphenol

2-(3-amino-1,2-oxazol-5-yl)-6-methoxy-3-methylphenol (PubChem CID 136993784) has the molecular formula C11H12N2O3 and a molecular weight of 220.23 g/mol. Its IUPAC name is 2-(3-amino-1,2-oxazol-5-yl)-6-methoxy-3-methylphenol.

Molecular Properties

Compound Name2-(3-amino-1,2-oxazol-5-yl)-6-methoxy-3-methylphenol
PubChem CID136993784
Molecular FormulaC11H12N2O3
Molecular Weight220.23 g/mol
Exact Mass220.08
IUPAC Name2-(3-amino-1,2-oxazol-5-yl)-6-methoxy-3-methylphenol
SMILESCOc1ccc(C)c(-c2cc(N)no2)c1O
InChIInChI=1S/C11H12N2O3/c1-6-3-4-7(15-2)11(14)10(6)8-5-9(12)13-16-8/h3-5,14H,1-2H3,(H2,12,13)
InChIKeyYKQAAMYAJQKFMT-UHFFFAOYSA-N
XLogP1.95
TPSA81.51 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.23
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3-amino-1,2-oxazol-5-yl)-3-fluoro-6-methoxyphenol
CID 136968457
3-(3-amino-1,2-oxazol-5-yl)-2-fluoro-6-methoxyphenol
CID 117321250
5-(4-methoxy-3-methylphenyl)-1,2-oxazol-3-amine
CID 82112667
2-(3-amino-1,2-oxazol-5-yl)-5-chloro-6-methoxy-3-methylphenol
CID 136942364
2-(3-amino-1,2-oxazol-5-yl)-3-fluoro-6-methylphenol
CID 136998720
5-(3-chloro-6-methoxy-2-methylphenyl)-1,2-oxazol-3-amine
CID 117349806
2-(3-amino-1,2-oxazol-5-yl)-4-methoxy-6-methylphenol
CID 136993780
5-(2,6-difluoro-3,5-dimethoxyphenyl)-1,2-oxazol-3-amine
CID 117393407
5-(5-bromo-4-methoxy-2-methylphenyl)-1,2-oxazol-3-amine
CID 117454912
5-(2,3-dimethoxy-4,6-dimethylphenyl)-1,2-oxazol-3-amine
CID 117373527
5-(3-chloro-4-methoxyphenyl)-1,2-oxazol-3-amine
CID 82114977
5-(2-chloro-5-methoxy-4-methylphenyl)-1,2-oxazol-3-amine
CID 117349810

Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-1,2-oxazol-5-yl)-6-methoxy-3-methylphenol?
The IUPAC name of 2-(3-amino-1,2-oxazol-5-yl)-6-methoxy-3-methylphenol (CID 136993784) is 2-(3-amino-1,2-oxazol-5-yl)-6-methoxy-3-methylphenol.
What is the SMILES notation for 2-(3-amino-1,2-oxazol-5-yl)-6-methoxy-3-methylphenol?
The canonical SMILES for 2-(3-amino-1,2-oxazol-5-yl)-6-methoxy-3-methylphenol is COc1ccc(C)c(-c2cc(N)no2)c1O.
What is the InChIKey of 2-(3-amino-1,2-oxazol-5-yl)-6-methoxy-3-methylphenol?
The InChIKey is YKQAAMYAJQKFMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O3/c1-6-3-4-7(15-2)11(14)10(6)8-5-9(12)13-16-8/h3-5,14H,1-2H3,(H2,12,13).
What are the key properties of 2-(3-amino-1,2-oxazol-5-yl)-6-methoxy-3-methylphenol?
2-(3-amino-1,2-oxazol-5-yl)-6-methoxy-3-methylphenol has a molecular weight of 220.23 g/mol, XLogP of 1.95, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-1,2-oxazol-5-yl)-6-methoxy-3-methylphenol is sourced from PubChem (CID 136993784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).