4-(4-methoxyphenyl)-1,2-oxazole

C10H9NO2 — CID 18523672

IUPAC4-(4-methoxyphenyl)-1,2-oxazole
SMILESCOc1ccc(-c2cnoc2)cc1
InChIInChI=1S/C10H9NO2/c1-12-10-4-2-8(3-5-10)9-6-11-13-7-9/h2-7H,1H3
InChIKeyUMJHMCOCCDYXOE-UHFFFAOYSA-N
MW175.19 g/mol
LogP2.35
Rot. Bonds2

About 4-(4-methoxyphenyl)-1,2-oxazole

4-(4-methoxyphenyl)-1,2-oxazole (PubChem CID 18523672) has the molecular formula C10H9NO2 and a molecular weight of 175.19 g/mol. Its IUPAC name is 4-(4-methoxyphenyl)-1,2-oxazole.

Molecular Properties

Compound Name4-(4-methoxyphenyl)-1,2-oxazole
PubChem CID18523672
Molecular FormulaC10H9NO2
Molecular Weight175.19 g/mol
Exact Mass175.06
IUPAC Name4-(4-methoxyphenyl)-1,2-oxazole
SMILESCOc1ccc(-c2cnoc2)cc1
InChIInChI=1S/C10H9NO2/c1-12-10-4-2-8(3-5-10)9-6-11-13-7-9/h2-7H,1H3
InChIKeyUMJHMCOCCDYXOE-UHFFFAOYSA-N
XLogP2.35
TPSA35.26 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxyphenyl)-1,2-oxazole?
The IUPAC name of 4-(4-methoxyphenyl)-1,2-oxazole (CID 18523672) is 4-(4-methoxyphenyl)-1,2-oxazole.
What is the SMILES notation for 4-(4-methoxyphenyl)-1,2-oxazole?
The canonical SMILES for 4-(4-methoxyphenyl)-1,2-oxazole is COc1ccc(-c2cnoc2)cc1.
What is the InChIKey of 4-(4-methoxyphenyl)-1,2-oxazole?
The InChIKey is UMJHMCOCCDYXOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO2/c1-12-10-4-2-8(3-5-10)9-6-11-13-7-9/h2-7H,1H3.
What are the key properties of 4-(4-methoxyphenyl)-1,2-oxazole?
4-(4-methoxyphenyl)-1,2-oxazole has a molecular weight of 175.19 g/mol, XLogP of 2.35, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxyphenyl)-1,2-oxazole is sourced from PubChem (CID 18523672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).