[4-[[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]methoxy]phenyl]methanol

C16H15NO4 — CID 68886081

IUPAC[4-[[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]methoxy]phenyl]methanol
SMILESCc1oc(-c2ccco2)nc1COc1ccc(CO)cc1
InChIInChI=1S/C16H15NO4/c1-11-14(17-16(21-11)15-3-2-8-19-15)10-20-13-6-4-12(9-18)5-7-13/h2-8,18H,9-10H2,1H3
InChIKeyLXWDBZQAPVXMOD-UHFFFAOYSA-N
MW285.30 g/mol
LogP3.31
Rot. Bonds5

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

[4-[[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]methoxy]phenyl]methanol (PubChem CID 68886081) has the molecular formula C16H15NO4 and a molecular weight of 285.30 g/mol. Its IUPAC name is [4-[[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]methoxy]phenyl]methanol.

Molecular Properties

Compound Name[4-[[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]methoxy]phenyl]methanol
PubChem CID68886081
Molecular FormulaC16H15NO4
Molecular Weight285.30 g/mol
Exact Mass285.10
IUPAC Name[4-[[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]methoxy]phenyl]methanol
SMILESCc1oc(-c2ccco2)nc1COc1ccc(CO)cc1
InChIInChI=1S/C16H15NO4/c1-11-14(17-16(21-11)15-3-2-8-19-15)10-20-13-6-4-12(9-18)5-7-13/h2-8,18H,9-10H2,1H3
InChIKeyLXWDBZQAPVXMOD-UHFFFAOYSA-N
XLogP3.31
TPSA68.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [4-[[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]methoxy]phenyl]methanol?
The IUPAC name of [4-[[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]methoxy]phenyl]methanol (CID 68886081) is [4-[[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]methoxy]phenyl]methanol.
What is the SMILES notation for [4-[[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]methoxy]phenyl]methanol?
The canonical SMILES for [4-[[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]methoxy]phenyl]methanol is Cc1oc(-c2ccco2)nc1COc1ccc(CO)cc1.
What is the InChIKey of [4-[[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]methoxy]phenyl]methanol?
The InChIKey is LXWDBZQAPVXMOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO4/c1-11-14(17-16(21-11)15-3-2-8-19-15)10-20-13-6-4-12(9-18)5-7-13/h2-8,18H,9-10H2,1H3.
What are the key properties of [4-[[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]methoxy]phenyl]methanol?
[4-[[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]methoxy]phenyl]methanol has a molecular weight of 285.30 g/mol, XLogP of 3.31, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]methoxy]phenyl]methanol is sourced from PubChem (CID 68886081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).