4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-phenylbenzamide

C19H18N2O3 — CID 2574590

IUPAC4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-phenylbenzamide
SMILESCc1noc(C)c1COc1ccc(C(=O)Nc2ccccc2)cc1
InChIInChI=1S/C19H18N2O3/c1-13-18(14(2)24-21-13)12-23-17-10-8-15(9-11-17)19(22)20-16-6-4-3-5-7-16/h3-11H,12H2,1-2H3,(H,20,22)
InChIKeyZAAZJKGIODLMTJ-UHFFFAOYSA-N
MW322.36 g/mol
LogP4.12
Rot. Bonds5

About 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-phenylbenzamide

4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-phenylbenzamide (PubChem CID 2574590) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-phenylbenzamide.

Molecular Properties

Compound Name4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-phenylbenzamide
PubChem CID2574590
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC Name4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-phenylbenzamide
SMILESCc1noc(C)c1COc1ccc(C(=O)Nc2ccccc2)cc1
InChIInChI=1S/C19H18N2O3/c1-13-18(14(2)24-21-13)12-23-17-10-8-15(9-11-17)19(22)20-16-6-4-3-5-7-16/h3-11H,12H2,1-2H3,(H,20,22)
InChIKeyZAAZJKGIODLMTJ-UHFFFAOYSA-N
XLogP4.12
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-phenylbenzamide?
The IUPAC name of 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-phenylbenzamide (CID 2574590) is 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-phenylbenzamide.
What is the SMILES notation for 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-phenylbenzamide?
The canonical SMILES for 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-phenylbenzamide is Cc1noc(C)c1COc1ccc(C(=O)Nc2ccccc2)cc1.
What is the InChIKey of 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-phenylbenzamide?
The InChIKey is ZAAZJKGIODLMTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3/c1-13-18(14(2)24-21-13)12-23-17-10-8-15(9-11-17)19(22)20-16-6-4-3-5-7-16/h3-11H,12H2,1-2H3,(H,20,22).
What are the key properties of 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-phenylbenzamide?
4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-phenylbenzamide has a molecular weight of 322.36 g/mol, XLogP of 4.12, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-phenylbenzamide is sourced from PubChem (CID 2574590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).