2-methyl-1,3-oxazol-4-ol

C4H5NO2 — CID 54325138

IUPAC2-methyl-1,3-oxazol-4-ol
SMILESCc1nc(O)co1
InChIInChI=1S/C4H5NO2/c1-3-5-4(6)2-7-3/h2,6H,1H3
InChIKeySUJOXDGDLGETPR-UHFFFAOYSA-N
MW99.09 g/mol
LogP0.69
Rot. Bonds

About 2-methyl-1,3-oxazol-4-ol

2-methyl-1,3-oxazol-4-ol (PubChem CID 54325138) has the molecular formula C4H5NO2 and a molecular weight of 99.09 g/mol. Its IUPAC name is 2-methyl-1,3-oxazol-4-ol.

Molecular Properties

Compound Name2-methyl-1,3-oxazol-4-ol
PubChem CID54325138
Molecular FormulaC4H5NO2
Molecular Weight99.09 g/mol
Exact Mass99.03
IUPAC Name2-methyl-1,3-oxazol-4-ol
SMILESCc1nc(O)co1
InChIInChI=1S/C4H5NO2/c1-3-5-4(6)2-7-3/h2,6H,1H3
InChIKeySUJOXDGDLGETPR-UHFFFAOYSA-N
XLogP0.69
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.09
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-Bromo-1,3-oxazol-2-yl)methanol
CID 67460262
2-(Trifluoromethyl)oxazol-4-ol
CID 90687808
2-Methyl-4-(trifluoromethoxy)-1,3-oxazole
CID 118466321
[2-(Fluoromethyl)-1,3-oxazol-4-yl] acetate
CID 174658936
2-(Fluoromethyl)-1,3-oxazol-4-ol
CID 84762088
2-(Difluoromethyl)-1,3-oxazol-4-ol
CID 84762406
2-(2-Fluoropropan-2-yl)-1,3-oxazol-4-ol
CID 84762858
2-(1,1-Difluoroethyl)-1,3-oxazol-4-ol
CID 84763086
2-Chloro-1,3-oxazol-4-ol
CID 53809832
1-(4-Hydroxy-1,3-oxazol-2-yl)propan-2-one
CID 53975164
2-Ethenyl-1,3-oxazol-4-ol
CID 54314049
4-Hydroxy-1,3-oxazole-2-carboxylic acid
CID 54552667

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1,3-oxazol-4-ol?
The IUPAC name of 2-methyl-1,3-oxazol-4-ol (CID 54325138) is 2-methyl-1,3-oxazol-4-ol.
What is the SMILES notation for 2-methyl-1,3-oxazol-4-ol?
The canonical SMILES for 2-methyl-1,3-oxazol-4-ol is Cc1nc(O)co1.
What is the InChIKey of 2-methyl-1,3-oxazol-4-ol?
The InChIKey is SUJOXDGDLGETPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5NO2/c1-3-5-4(6)2-7-3/h2,6H,1H3.
What are the key properties of 2-methyl-1,3-oxazol-4-ol?
2-methyl-1,3-oxazol-4-ol has a molecular weight of 99.09 g/mol, XLogP of 0.69, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1,3-oxazol-4-ol is sourced from PubChem (CID 54325138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).