5-methoxy-2-(4-phenyl-1,2-oxazol-5-yl)phenol

C16H13NO3 — CID 135657525

IUPAC5-methoxy-2-(4-phenyl-1,2-oxazol-5-yl)phenol
SMILESCOc1ccc(-c2oncc2-c2ccccc2)c(O)c1
InChIInChI=1S/C16H13NO3/c1-19-12-7-8-13(15(18)9-12)16-14(10-17-20-16)11-5-3-2-4-6-11/h2-10,18H,1H3
InChIKeySCTPSQZXBZIJKV-UHFFFAOYSA-N
MW267.28 g/mol
LogP3.72
Rot. Bonds3

About 5-methoxy-2-(4-phenyl-1,2-oxazol-5-yl)phenol

5-methoxy-2-(4-phenyl-1,2-oxazol-5-yl)phenol (PubChem CID 135657525) has the molecular formula C16H13NO3 and a molecular weight of 267.28 g/mol. Its IUPAC name is 5-methoxy-2-(4-phenyl-1,2-oxazol-5-yl)phenol.

Molecular Properties

Compound Name5-methoxy-2-(4-phenyl-1,2-oxazol-5-yl)phenol
PubChem CID135657525
Molecular FormulaC16H13NO3
Molecular Weight267.28 g/mol
Exact Mass267.09
IUPAC Name5-methoxy-2-(4-phenyl-1,2-oxazol-5-yl)phenol
SMILESCOc1ccc(-c2oncc2-c2ccccc2)c(O)c1
InChIInChI=1S/C16H13NO3/c1-19-12-7-8-13(15(18)9-12)16-14(10-17-20-16)11-5-3-2-4-6-11/h2-10,18H,1H3
InChIKeySCTPSQZXBZIJKV-UHFFFAOYSA-N
XLogP3.72
TPSA55.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.28
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-(4-phenyl-1,2-oxazol-5-yl)phenol?
The IUPAC name of 5-methoxy-2-(4-phenyl-1,2-oxazol-5-yl)phenol (CID 135657525) is 5-methoxy-2-(4-phenyl-1,2-oxazol-5-yl)phenol.
What is the SMILES notation for 5-methoxy-2-(4-phenyl-1,2-oxazol-5-yl)phenol?
The canonical SMILES for 5-methoxy-2-(4-phenyl-1,2-oxazol-5-yl)phenol is COc1ccc(-c2oncc2-c2ccccc2)c(O)c1.
What is the InChIKey of 5-methoxy-2-(4-phenyl-1,2-oxazol-5-yl)phenol?
The InChIKey is SCTPSQZXBZIJKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO3/c1-19-12-7-8-13(15(18)9-12)16-14(10-17-20-16)11-5-3-2-4-6-11/h2-10,18H,1H3.
What are the key properties of 5-methoxy-2-(4-phenyl-1,2-oxazol-5-yl)phenol?
5-methoxy-2-(4-phenyl-1,2-oxazol-5-yl)phenol has a molecular weight of 267.28 g/mol, XLogP of 3.72, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-(4-phenyl-1,2-oxazol-5-yl)phenol is sourced from PubChem (CID 135657525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).