[3-(2-methoxyphenyl)-5-methyl-1,2-oxazol-4-yl]methanol

C12H13NO3 — CID 10932935

IUPAC[3-(2-methoxyphenyl)-5-methyl-1,2-oxazol-4-yl]methanol
SMILESCOc1ccccc1-c1noc(C)c1CO
InChIInChI=1S/C12H13NO3/c1-8-10(7-14)12(13-16-8)9-5-3-4-6-11(9)15-2/h3-6,14H,7H2,1-2H3
InChIKeyPICFVDCGGRVNNY-UHFFFAOYSA-N
MW219.24 g/mol
LogP2.15
Rot. Bonds3

About [3-(2-methoxyphenyl)-5-methyl-1,2-oxazol-4-yl]methanol

[3-(2-methoxyphenyl)-5-methyl-1,2-oxazol-4-yl]methanol (PubChem CID 10932935) has the molecular formula C12H13NO3 and a molecular weight of 219.24 g/mol. Its IUPAC name is [3-(2-methoxyphenyl)-5-methyl-1,2-oxazol-4-yl]methanol.

Molecular Properties

Compound Name[3-(2-methoxyphenyl)-5-methyl-1,2-oxazol-4-yl]methanol
PubChem CID10932935
Molecular FormulaC12H13NO3
Molecular Weight219.24 g/mol
Exact Mass219.09
IUPAC Name[3-(2-methoxyphenyl)-5-methyl-1,2-oxazol-4-yl]methanol
SMILESCOc1ccccc1-c1noc(C)c1CO
InChIInChI=1S/C12H13NO3/c1-8-10(7-14)12(13-16-8)9-5-3-4-6-11(9)15-2/h3-6,14H,7H2,1-2H3
InChIKeyPICFVDCGGRVNNY-UHFFFAOYSA-N
XLogP2.15
TPSA55.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.24
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[5-(2,6-dimethylphenyl)-3-(2-methoxyphenyl)-1,2-oxazol-4-yl]methanol
CID 131867266
[3-(5-chloro-2-methoxyphenyl)-5-methyl-1,2-oxazol-4-yl]methanol
CID 11747157
[4-(2-methoxyphenyl)-5-methyl-1,2-oxazol-3-yl]methanol
CID 174708303
[5-(3,5-difluorophenyl)-3-(2-methoxyphenyl)-1,2-oxazol-4-yl]methanol
CID 131868139
[3-(4-methoxy-3-methylphenyl)-5-methyl-1,2-oxazol-4-yl]methanol
CID 82371289
3-(2-methoxyphenyl)-5-methyl-1,2-oxazole-4-carboxylate
CID 7446909
[5-(2-methoxyphenyl)-2-methylfuran-3-yl]methanol
CID 68515517
[5-(2,3-dichlorophenyl)-3-(2,3-dimethoxyphenyl)-1,2-oxazol-4-yl]methanol
CID 131867931
[5-propyl-3-[2-(trifluoromethoxy)phenyl]-1,2-oxazol-4-yl]methanol
CID 68722614
[3-(2,5-dimethoxyphenyl)-5-(3,5-dimethylphenyl)-1,2-oxazol-4-yl]methanol
CID 131867845
[5-(2-methoxyphenyl)-4-methyl-1,3-oxazol-2-yl]methanol
CID 105473690
[5-(3-methoxyphenyl)-3-naphthalen-1-yl-1,2-oxazol-4-yl]methanol
CID 131866931

Frequently Asked Questions

What is the IUPAC name of [3-(2-methoxyphenyl)-5-methyl-1,2-oxazol-4-yl]methanol?
The IUPAC name of [3-(2-methoxyphenyl)-5-methyl-1,2-oxazol-4-yl]methanol (CID 10932935) is [3-(2-methoxyphenyl)-5-methyl-1,2-oxazol-4-yl]methanol.
What is the SMILES notation for [3-(2-methoxyphenyl)-5-methyl-1,2-oxazol-4-yl]methanol?
The canonical SMILES for [3-(2-methoxyphenyl)-5-methyl-1,2-oxazol-4-yl]methanol is COc1ccccc1-c1noc(C)c1CO.
What is the InChIKey of [3-(2-methoxyphenyl)-5-methyl-1,2-oxazol-4-yl]methanol?
The InChIKey is PICFVDCGGRVNNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO3/c1-8-10(7-14)12(13-16-8)9-5-3-4-6-11(9)15-2/h3-6,14H,7H2,1-2H3.
What are the key properties of [3-(2-methoxyphenyl)-5-methyl-1,2-oxazol-4-yl]methanol?
[3-(2-methoxyphenyl)-5-methyl-1,2-oxazol-4-yl]methanol has a molecular weight of 219.24 g/mol, XLogP of 2.15, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-methoxyphenyl)-5-methyl-1,2-oxazol-4-yl]methanol is sourced from PubChem (CID 10932935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).