2-[[5-(1-hydroxyethyl)-1,3-oxazol-2-yl]methyl]phenol

C12H13NO3 — CID 115086774

IUPAC2-[[5-(1-hydroxyethyl)-1,3-oxazol-2-yl]methyl]phenol
SMILESCC(O)c1cnc(Cc2ccccc2O)o1
InChIInChI=1S/C12H13NO3/c1-8(14)11-7-13-12(16-11)6-9-4-2-3-5-10(9)15/h2-5,7-8,14-15H,6H2,1H3
InChIKeyUKKTWRKWYAJSTR-UHFFFAOYSA-N
MW219.24 g/mol
LogP2.02
Rot. Bonds3

About 2-[[5-(1-hydroxyethyl)-1,3-oxazol-2-yl]methyl]phenol

2-[[5-(1-hydroxyethyl)-1,3-oxazol-2-yl]methyl]phenol (PubChem CID 115086774) has the molecular formula C12H13NO3 and a molecular weight of 219.24 g/mol. Its IUPAC name is 2-[[5-(1-hydroxyethyl)-1,3-oxazol-2-yl]methyl]phenol.

Molecular Properties

Compound Name2-[[5-(1-hydroxyethyl)-1,3-oxazol-2-yl]methyl]phenol
PubChem CID115086774
Molecular FormulaC12H13NO3
Molecular Weight219.24 g/mol
Exact Mass219.09
IUPAC Name2-[[5-(1-hydroxyethyl)-1,3-oxazol-2-yl]methyl]phenol
SMILESCC(O)c1cnc(Cc2ccccc2O)o1
InChIInChI=1S/C12H13NO3/c1-8(14)11-7-13-12(16-11)6-9-4-2-3-5-10(9)15/h2-5,7-8,14-15H,6H2,1H3
InChIKeyUKKTWRKWYAJSTR-UHFFFAOYSA-N
XLogP2.02
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.24
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-[(2-hydroxyphenyl)methyl]-1,3-oxazol-5-yl]ethanone
CID 115086783
2-[[4-(1-hydroxyethyl)-1,3-oxazol-2-yl]methyl]phenol
CID 115083874
1-[2-[(2-hydroxyphenyl)methyl]-1,3-oxazol-5-yl]propan-2-one
CID 115086811
1-[2-[(4-chlorophenyl)methyl]-1,3-oxazol-5-yl]ethanol
CID 115086885
2-[[5-[3-(methylamino)propyl]-1,3-oxazol-2-yl]methyl]phenol
CID 115086866
2-[2-[(2-methoxyphenyl)methyl]-1,3-oxazol-5-yl]propan-1-ol
CID 115086826
2-[[4-(2-hydroxypropyl)-1,3-oxazol-2-yl]methyl]phenol
CID 115083902
2-[[5-(2-hydroxypropyl)-1,3-thiazol-2-yl]methyl]phenol
CID 115091474
1-[2-[(2-chlorophenyl)methyl]-1,3-oxazol-5-yl]propan-2-ol
CID 115086793
1-(2-phenyl-1,3-oxazol-5-yl)ethanol
CID 115087081
2-[[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl]phenol
CID 80740542
2-[(3-butan-2-yl-1,2,4-oxadiazol-5-yl)methyl]phenol
CID 80740766

Frequently Asked Questions

What is the IUPAC name of 2-[[5-(1-hydroxyethyl)-1,3-oxazol-2-yl]methyl]phenol?
The IUPAC name of 2-[[5-(1-hydroxyethyl)-1,3-oxazol-2-yl]methyl]phenol (CID 115086774) is 2-[[5-(1-hydroxyethyl)-1,3-oxazol-2-yl]methyl]phenol.
What is the SMILES notation for 2-[[5-(1-hydroxyethyl)-1,3-oxazol-2-yl]methyl]phenol?
The canonical SMILES for 2-[[5-(1-hydroxyethyl)-1,3-oxazol-2-yl]methyl]phenol is CC(O)c1cnc(Cc2ccccc2O)o1.
What is the InChIKey of 2-[[5-(1-hydroxyethyl)-1,3-oxazol-2-yl]methyl]phenol?
The InChIKey is UKKTWRKWYAJSTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO3/c1-8(14)11-7-13-12(16-11)6-9-4-2-3-5-10(9)15/h2-5,7-8,14-15H,6H2,1H3.
What are the key properties of 2-[[5-(1-hydroxyethyl)-1,3-oxazol-2-yl]methyl]phenol?
2-[[5-(1-hydroxyethyl)-1,3-oxazol-2-yl]methyl]phenol has a molecular weight of 219.24 g/mol, XLogP of 2.02, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[5-(1-hydroxyethyl)-1,3-oxazol-2-yl]methyl]phenol is sourced from PubChem (CID 115086774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).