2-(4-methoxyphenyl)-5-pyridin-4-yl-1,3-oxazole

C15H12N2O2 — CID 10422311

IUPAC2-(4-methoxyphenyl)-5-pyridin-4-yl-1,3-oxazole
SMILESCOc1ccc(-c2ncc(-c3ccncc3)o2)cc1
InChIInChI=1S/C15H12N2O2/c1-18-13-4-2-12(3-5-13)15-17-10-14(19-15)11-6-8-16-9-7-11/h2-10H,1H3
InChIKeyWDTDRXNDSFVNLQ-UHFFFAOYSA-N
MW252.27 g/mol
LogP3.41
Rot. Bonds3

About 2-(4-methoxyphenyl)-5-pyridin-4-yl-1,3-oxazole

2-(4-methoxyphenyl)-5-pyridin-4-yl-1,3-oxazole (PubChem CID 10422311) has the molecular formula C15H12N2O2 and a molecular weight of 252.27 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-5-pyridin-4-yl-1,3-oxazole.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-5-pyridin-4-yl-1,3-oxazole
PubChem CID10422311
Molecular FormulaC15H12N2O2
Molecular Weight252.27 g/mol
Exact Mass252.09
IUPAC Name2-(4-methoxyphenyl)-5-pyridin-4-yl-1,3-oxazole
SMILESCOc1ccc(-c2ncc(-c3ccncc3)o2)cc1
InChIInChI=1S/C15H12N2O2/c1-18-13-4-2-12(3-5-13)15-17-10-14(19-15)11-6-8-16-9-7-11/h2-10H,1H3
InChIKeyWDTDRXNDSFVNLQ-UHFFFAOYSA-N
XLogP3.41
TPSA48.15 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-5-pyridin-4-yl-1,3-oxazole?
The IUPAC name of 2-(4-methoxyphenyl)-5-pyridin-4-yl-1,3-oxazole (CID 10422311) is 2-(4-methoxyphenyl)-5-pyridin-4-yl-1,3-oxazole.
What is the SMILES notation for 2-(4-methoxyphenyl)-5-pyridin-4-yl-1,3-oxazole?
The canonical SMILES for 2-(4-methoxyphenyl)-5-pyridin-4-yl-1,3-oxazole is COc1ccc(-c2ncc(-c3ccncc3)o2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-5-pyridin-4-yl-1,3-oxazole?
The InChIKey is WDTDRXNDSFVNLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2/c1-18-13-4-2-12(3-5-13)15-17-10-14(19-15)11-6-8-16-9-7-11/h2-10H,1H3.
What are the key properties of 2-(4-methoxyphenyl)-5-pyridin-4-yl-1,3-oxazole?
2-(4-methoxyphenyl)-5-pyridin-4-yl-1,3-oxazole has a molecular weight of 252.27 g/mol, XLogP of 3.41, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-5-pyridin-4-yl-1,3-oxazole is sourced from PubChem (CID 10422311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).