2-(5-amino-1,2-oxazol-3-yl)-4-methoxy-5-methylphenol

C11H12N2O3 — CID 136993797

IUPAC2-(5-amino-1,2-oxazol-3-yl)-4-methoxy-5-methylphenol
SMILESCOc1cc(-c2cc(N)on2)c(O)cc1C
InChIInChI=1S/C11H12N2O3/c1-6-3-9(14)7(4-10(6)15-2)8-5-11(12)16-13-8/h3-5,14H,12H2,1-2H3
InChIKeyFSZJJXFUTPQVCH-UHFFFAOYSA-N
MW220.23 g/mol
LogP1.95
Rot. Bonds2

About 2-(5-amino-1,2-oxazol-3-yl)-4-methoxy-5-methylphenol

2-(5-amino-1,2-oxazol-3-yl)-4-methoxy-5-methylphenol (PubChem CID 136993797) has the molecular formula C11H12N2O3 and a molecular weight of 220.23 g/mol. Its IUPAC name is 2-(5-amino-1,2-oxazol-3-yl)-4-methoxy-5-methylphenol.

Molecular Properties

Compound Name2-(5-amino-1,2-oxazol-3-yl)-4-methoxy-5-methylphenol
PubChem CID136993797
Molecular FormulaC11H12N2O3
Molecular Weight220.23 g/mol
Exact Mass220.08
IUPAC Name2-(5-amino-1,2-oxazol-3-yl)-4-methoxy-5-methylphenol
SMILESCOc1cc(-c2cc(N)on2)c(O)cc1C
InChIInChI=1S/C11H12N2O3/c1-6-3-9(14)7(4-10(6)15-2)8-5-11(12)16-13-8/h3-5,14H,12H2,1-2H3
InChIKeyFSZJJXFUTPQVCH-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-(5-amino-1,2-oxazol-3-yl)-5-fluoro-4-methoxyphenol
CID 136968465
2-(5-amino-1,2-oxazol-3-yl)-5-methylbenzene-1,4-diol
CID 136998676
4-(5-amino-1,2-oxazol-3-yl)-5-fluoro-2-methoxyphenol
CID 136968470
4-(5-amino-1,2-oxazol-3-yl)-5-bromo-2-methoxyphenol
CID 136931171
5-(5-amino-1,2-oxazol-3-yl)-4-hydroxy-2-methoxybenzoic acid
CID 136998089
3-(2,5-dimethoxy-3,4-dimethylphenyl)-1,2-oxazol-5-amine
CID 117373551
3-(5-amino-1,2-oxazol-3-yl)-2,6-difluoro-5-methoxyphenol
CID 117356932
3-(4-bromo-2,5-dimethoxyphenyl)-1,2-oxazol-5-amine
CID 3407261
2-(5-amino-1,2-oxazol-3-yl)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-ol
CID 136963436
2-(3-amino-1H-pyrazol-5-yl)-4-methoxy-5-methylphenol
CID 136993747
3-(2,3-dimethoxy-4-methylphenyl)-1,2-oxazol-5-amine
CID 117340291
3-(3-bromo-2,5-dimethoxy-4-methylphenyl)-1,2-oxazol-5-amine
CID 117498171

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-1,2-oxazol-3-yl)-4-methoxy-5-methylphenol?
The IUPAC name of 2-(5-amino-1,2-oxazol-3-yl)-4-methoxy-5-methylphenol (CID 136993797) is 2-(5-amino-1,2-oxazol-3-yl)-4-methoxy-5-methylphenol.
What is the SMILES notation for 2-(5-amino-1,2-oxazol-3-yl)-4-methoxy-5-methylphenol?
The canonical SMILES for 2-(5-amino-1,2-oxazol-3-yl)-4-methoxy-5-methylphenol is COc1cc(-c2cc(N)on2)c(O)cc1C.
What is the InChIKey of 2-(5-amino-1,2-oxazol-3-yl)-4-methoxy-5-methylphenol?
The InChIKey is FSZJJXFUTPQVCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O3/c1-6-3-9(14)7(4-10(6)15-2)8-5-11(12)16-13-8/h3-5,14H,12H2,1-2H3.
What are the key properties of 2-(5-amino-1,2-oxazol-3-yl)-4-methoxy-5-methylphenol?
2-(5-amino-1,2-oxazol-3-yl)-4-methoxy-5-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-(5-amino-1,2-oxazol-3-yl)-4-methoxy-5-methylphenol is sourced from PubChem (CID 136993797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).