2-(2-phenylmethoxyphenyl)-1,3-oxazole;pyridine

C21H18N2O2 — CID 175115317

IUPAC2-(2-phenylmethoxyphenyl)-1,3-oxazole;pyridine
SMILESc1ccc(COc2ccccc2-c2ncco2)cc1.c1ccncc1
InChIInChI=1S/C16H13NO2.C5H5N/c1-2-6-13(7-3-1)12-19-15-9-5-4-8-14(15)16-17-10-11-18-16;1-2-4-6-5-3-1/h1-11H,12H2;1-5H
InChIKeyODGMVIYKYDKOJT-UHFFFAOYSA-N
MW330.39 g/mol
LogP5.00
Rot. Bonds4

About 2-(2-phenylmethoxyphenyl)-1,3-oxazole;pyridine

2-(2-phenylmethoxyphenyl)-1,3-oxazole;pyridine (PubChem CID 175115317) has the molecular formula C21H18N2O2 and a molecular weight of 330.39 g/mol. Its IUPAC name is 2-(2-phenylmethoxyphenyl)-1,3-oxazole;pyridine.

Molecular Properties

Compound Name2-(2-phenylmethoxyphenyl)-1,3-oxazole;pyridine
PubChem CID175115317
Molecular FormulaC21H18N2O2
Molecular Weight330.39 g/mol
Exact Mass330.14
IUPAC Name2-(2-phenylmethoxyphenyl)-1,3-oxazole;pyridine
SMILESc1ccc(COc2ccccc2-c2ncco2)cc1.c1ccncc1
InChIInChI=1S/C16H13NO2.C5H5N/c1-2-6-13(7-3-1)12-19-15-9-5-4-8-14(15)16-17-10-11-18-16;1-2-4-6-5-3-1/h1-11H,12H2;1-5H
InChIKeyODGMVIYKYDKOJT-UHFFFAOYSA-N
XLogP5.00
TPSA48.15 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.39
LogP ≤ 55.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-phenylmethoxyphenyl)-1,3-oxazole;pyridine?
The IUPAC name of 2-(2-phenylmethoxyphenyl)-1,3-oxazole;pyridine (CID 175115317) is 2-(2-phenylmethoxyphenyl)-1,3-oxazole;pyridine.
What is the SMILES notation for 2-(2-phenylmethoxyphenyl)-1,3-oxazole;pyridine?
The canonical SMILES for 2-(2-phenylmethoxyphenyl)-1,3-oxazole;pyridine is c1ccc(COc2ccccc2-c2ncco2)cc1.c1ccncc1.
What is the InChIKey of 2-(2-phenylmethoxyphenyl)-1,3-oxazole;pyridine?
The InChIKey is ODGMVIYKYDKOJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO2.C5H5N/c1-2-6-13(7-3-1)12-19-15-9-5-4-8-14(15)16-17-10-11-18-16;1-2-4-6-5-3-1/h1-11H,12H2;1-5H.
What are the key properties of 2-(2-phenylmethoxyphenyl)-1,3-oxazole;pyridine?
2-(2-phenylmethoxyphenyl)-1,3-oxazole;pyridine has a molecular weight of 330.39 g/mol, XLogP of 5.00, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenylmethoxyphenyl)-1,3-oxazole;pyridine is sourced from PubChem (CID 175115317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).