5-methoxy-3-methyl-2-(4-pyridin-2-yl-1,2-oxazol-5-yl)phenol

C16H14N2O3 — CID 135584315

IUPAC5-methoxy-3-methyl-2-(4-pyridin-2-yl-1,2-oxazol-5-yl)phenol
SMILESCOc1cc(C)c(-c2oncc2-c2ccccn2)c(O)c1
InChIInChI=1S/C16H14N2O3/c1-10-7-11(20-2)8-14(19)15(10)16-12(9-18-21-16)13-5-3-4-6-17-13/h3-9,19H,1-2H3
InChIKeyMEGYVXQDDDAYBW-UHFFFAOYSA-N
MW282.30 g/mol
LogP3.43
Rot. Bonds3

About 5-methoxy-3-methyl-2-(4-pyridin-2-yl-1,2-oxazol-5-yl)phenol

5-methoxy-3-methyl-2-(4-pyridin-2-yl-1,2-oxazol-5-yl)phenol (PubChem CID 135584315) has the molecular formula C16H14N2O3 and a molecular weight of 282.30 g/mol. Its IUPAC name is 5-methoxy-3-methyl-2-(4-pyridin-2-yl-1,2-oxazol-5-yl)phenol.

Molecular Properties

Compound Name5-methoxy-3-methyl-2-(4-pyridin-2-yl-1,2-oxazol-5-yl)phenol
PubChem CID135584315
Molecular FormulaC16H14N2O3
Molecular Weight282.30 g/mol
Exact Mass282.10
IUPAC Name5-methoxy-3-methyl-2-(4-pyridin-2-yl-1,2-oxazol-5-yl)phenol
SMILESCOc1cc(C)c(-c2oncc2-c2ccccn2)c(O)c1
InChIInChI=1S/C16H14N2O3/c1-10-7-11(20-2)8-14(19)15(10)16-12(9-18-21-16)13-5-3-4-6-17-13/h3-9,19H,1-2H3
InChIKeyMEGYVXQDDDAYBW-UHFFFAOYSA-N
XLogP3.43
TPSA68.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-3-methyl-2-(4-pyridin-2-yl-1,2-oxazol-5-yl)phenol?
The IUPAC name of 5-methoxy-3-methyl-2-(4-pyridin-2-yl-1,2-oxazol-5-yl)phenol (CID 135584315) is 5-methoxy-3-methyl-2-(4-pyridin-2-yl-1,2-oxazol-5-yl)phenol.
What is the SMILES notation for 5-methoxy-3-methyl-2-(4-pyridin-2-yl-1,2-oxazol-5-yl)phenol?
The canonical SMILES for 5-methoxy-3-methyl-2-(4-pyridin-2-yl-1,2-oxazol-5-yl)phenol is COc1cc(C)c(-c2oncc2-c2ccccn2)c(O)c1.
What is the InChIKey of 5-methoxy-3-methyl-2-(4-pyridin-2-yl-1,2-oxazol-5-yl)phenol?
The InChIKey is MEGYVXQDDDAYBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O3/c1-10-7-11(20-2)8-14(19)15(10)16-12(9-18-21-16)13-5-3-4-6-17-13/h3-9,19H,1-2H3.
What are the key properties of 5-methoxy-3-methyl-2-(4-pyridin-2-yl-1,2-oxazol-5-yl)phenol?
5-methoxy-3-methyl-2-(4-pyridin-2-yl-1,2-oxazol-5-yl)phenol has a molecular weight of 282.30 g/mol, XLogP of 3.43, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-3-methyl-2-(4-pyridin-2-yl-1,2-oxazol-5-yl)phenol is sourced from PubChem (CID 135584315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).