2-[4-(4-methyl-1,3-oxazol-2-yl)phenyl]propan-2-ol

C13H15NO2 — CID 84682769

IUPAC2-[4-(4-methyl-1,3-oxazol-2-yl)phenyl]propan-2-ol
SMILESCc1coc(-c2ccc(C(C)(C)O)cc2)n1
InChIInChI=1S/C13H15NO2/c1-9-8-16-12(14-9)10-4-6-11(7-5-10)13(2,3)15/h4-8,15H,1-3H3
InChIKeyXNYLLGDVMSZXEL-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.88
Rot. Bonds2

About 2-[4-(4-methyl-1,3-oxazol-2-yl)phenyl]propan-2-ol

2-[4-(4-methyl-1,3-oxazol-2-yl)phenyl]propan-2-ol (PubChem CID 84682769) has the molecular formula C13H15NO2 and a molecular weight of 217.27 g/mol. Its IUPAC name is 2-[4-(4-methyl-1,3-oxazol-2-yl)phenyl]propan-2-ol.

Molecular Properties

Compound Name2-[4-(4-methyl-1,3-oxazol-2-yl)phenyl]propan-2-ol
PubChem CID84682769
Molecular FormulaC13H15NO2
Molecular Weight217.27 g/mol
Exact Mass217.11
IUPAC Name2-[4-(4-methyl-1,3-oxazol-2-yl)phenyl]propan-2-ol
SMILESCc1coc(-c2ccc(C(C)(C)O)cc2)n1
InChIInChI=1S/C13H15NO2/c1-9-8-16-12(14-9)10-4-6-11(7-5-10)13(2,3)15/h4-8,15H,1-3H3
InChIKeyXNYLLGDVMSZXEL-UHFFFAOYSA-N
XLogP2.88
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[[4-(4-methyl-1,3-oxazol-2-yl)phenyl]methyl]cyclopropan-1-ol
CID 117330636
O-[[4-(4-methyl-1,3-oxazol-2-yl)phenyl]methyl]hydroxylamine
CID 117292521
4-[4-(4-methyl-1,3-oxazol-2-yl)phenyl]-1,2-oxazol-5-amine
CID 117354707
4-methyl-2-(4-piperazin-1-ylphenyl)-1,3-oxazole
CID 82478157
1-[1-[4-(4-methyl-1,3-oxazol-2-yl)phenyl]cyclopropyl]ethanamine
CID 117358112
2-(4-fluorophenyl)-4-(2-isocyanopropan-2-yl)-1,3-oxazole
CID 123356610
3-hydroxy-N-[3-(4-methyl-1,3-oxazol-2-yl)phenyl]-3-phenylbutanamide
CID 110025780
2-[4-(2,4,4-trimethylpentan-2-yl)phenyl]-1,3-oxazole-4-carboxylic acid
CID 172634567
1-[3-(4-methyl-1,3-oxazol-2-yl)phenyl]ethanone
CID 115022186
2-[2-hydroxy-4-(4-methyl-1,3-oxazol-2-yl)phenyl]acetonitrile
CID 142250607
4-methyl-2-[4-(piperidin-4-ylmethyl)phenyl]-1,3-oxazole
CID 117394498
2-[3,5-bis(2-hydroxypropan-2-yl)phenyl]propan-2-ol;2-[4-(2-hydroxypropan-2-yl)phenyl]propan-2-ol
CID 67743225

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-methyl-1,3-oxazol-2-yl)phenyl]propan-2-ol?
The IUPAC name of 2-[4-(4-methyl-1,3-oxazol-2-yl)phenyl]propan-2-ol (CID 84682769) is 2-[4-(4-methyl-1,3-oxazol-2-yl)phenyl]propan-2-ol.
What is the SMILES notation for 2-[4-(4-methyl-1,3-oxazol-2-yl)phenyl]propan-2-ol?
The canonical SMILES for 2-[4-(4-methyl-1,3-oxazol-2-yl)phenyl]propan-2-ol is Cc1coc(-c2ccc(C(C)(C)O)cc2)n1.
What is the InChIKey of 2-[4-(4-methyl-1,3-oxazol-2-yl)phenyl]propan-2-ol?
The InChIKey is XNYLLGDVMSZXEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO2/c1-9-8-16-12(14-9)10-4-6-11(7-5-10)13(2,3)15/h4-8,15H,1-3H3.
What are the key properties of 2-[4-(4-methyl-1,3-oxazol-2-yl)phenyl]propan-2-ol?
2-[4-(4-methyl-1,3-oxazol-2-yl)phenyl]propan-2-ol has a molecular weight of 217.27 g/mol, XLogP of 2.88, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-methyl-1,3-oxazol-2-yl)phenyl]propan-2-ol is sourced from PubChem (CID 84682769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).