4-methyl-2-(1,2-oxazol-5-yl)phenol

C10H9NO2 — CID 3356746

IUPAC4-methyl-2-(1,2-oxazol-5-yl)phenol
SMILESCc1ccc(O)c(-c2ccno2)c1
InChIInChI=1S/C10H9NO2/c1-7-2-3-9(12)8(6-7)10-4-5-11-13-10/h2-6,12H,1H3
InChIKeyOZKYVNKXVHASGF-UHFFFAOYSA-N
MW175.19 g/mol
LogP2.36
Rot. Bonds1

About 4-methyl-2-(1,2-oxazol-5-yl)phenol

4-methyl-2-(1,2-oxazol-5-yl)phenol (PubChem CID 3356746) has the molecular formula C10H9NO2 and a molecular weight of 175.19 g/mol. Its IUPAC name is 4-methyl-2-(1,2-oxazol-5-yl)phenol.

Molecular Properties

Compound Name4-methyl-2-(1,2-oxazol-5-yl)phenol
PubChem CID3356746
Molecular FormulaC10H9NO2
Molecular Weight175.19 g/mol
Exact Mass175.06
IUPAC Name4-methyl-2-(1,2-oxazol-5-yl)phenol
SMILESCc1ccc(O)c(-c2ccno2)c1
InChIInChI=1S/C10H9NO2/c1-7-2-3-9(12)8(6-7)10-4-5-11-13-10/h2-6,12H,1H3
InChIKeyOZKYVNKXVHASGF-UHFFFAOYSA-N
XLogP2.36
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-Chloro-2-(5-isoxazolyl)phenol
CID 4199500
4-Chloro-2-(5-isoxazolyl)-5-methylphenol
CID 854042
2-(5-Isoxazolyl)phenol
CID 578506
4-Bromo-2-(5-isoxazolyl)phenol
CID 854043
2-[3-(4-Fluorophenyl)-5-isoxazolyl]-4-methylphenol
CID 873889
2-(3-Phenyl-5-isoxazolyl)phenol
CID 873352
4-Fluoro-2-(5-isoxazolyl)phenol
CID 2758985
5-(2-Butoxy-phenyl)-isoxazole
CID 11183547
4-Methyl-2-[3-(1,1,2,2-tetrafluoroethyl)-1,2-oxazol-5-yl]phenol
CID 762945
Phenol, 2-[3-(difluoromethyl)-5-isoxazolyl]-
CID 921675
2-[3-(1,1,2,2-Tetrafluoroethyl)-1,2-oxazol-5-yl]phenol
CID 800554
4-Methyl-2-[3-(trifluoromethyl)isoxazol-5-yl]phenol
CID 4692990

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(1,2-oxazol-5-yl)phenol?
The IUPAC name of 4-methyl-2-(1,2-oxazol-5-yl)phenol (CID 3356746) is 4-methyl-2-(1,2-oxazol-5-yl)phenol.
What is the SMILES notation for 4-methyl-2-(1,2-oxazol-5-yl)phenol?
The canonical SMILES for 4-methyl-2-(1,2-oxazol-5-yl)phenol is Cc1ccc(O)c(-c2ccno2)c1.
What is the InChIKey of 4-methyl-2-(1,2-oxazol-5-yl)phenol?
The InChIKey is OZKYVNKXVHASGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO2/c1-7-2-3-9(12)8(6-7)10-4-5-11-13-10/h2-6,12H,1H3.
What are the key properties of 4-methyl-2-(1,2-oxazol-5-yl)phenol?
4-methyl-2-(1,2-oxazol-5-yl)phenol has a molecular weight of 175.19 g/mol, XLogP of 2.36, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(1,2-oxazol-5-yl)phenol is sourced from PubChem (CID 3356746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).