3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]benzamide

C17H14N2O2 — CID 47051399

IUPAC3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]benzamide
SMILESCc1cccc(C(=O)Nc2cccc(-c3cnco3)c2)c1
InChIInChI=1S/C17H14N2O2/c1-12-4-2-6-14(8-12)17(20)19-15-7-3-5-13(9-15)16-10-18-11-21-16/h2-11H,1H3,(H,19,20)
InChIKeyPQZYZBGGANCSQJ-UHFFFAOYSA-N
MW278.31 g/mol
LogP3.90
Rot. Bonds3

About 3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]benzamide

3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]benzamide (PubChem CID 47051399) has the molecular formula C17H14N2O2 and a molecular weight of 278.31 g/mol. Its IUPAC name is 3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]benzamide.

Molecular Properties

Compound Name3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]benzamide
PubChem CID47051399
Molecular FormulaC17H14N2O2
Molecular Weight278.31 g/mol
Exact Mass278.11
IUPAC Name3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]benzamide
SMILESCc1cccc(C(=O)Nc2cccc(-c3cnco3)c2)c1
InChIInChI=1S/C17H14N2O2/c1-12-4-2-6-14(8-12)17(20)19-15-7-3-5-13(9-15)16-10-18-11-21-16/h2-11H,1H3,(H,19,20)
InChIKeyPQZYZBGGANCSQJ-UHFFFAOYSA-N
XLogP3.90
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]propanamide
CID 47265687
2,4-dimethyl-N-[3-(1,3-oxazol-5-yl)phenyl]-6-oxopyran-3-carboxamide
CID 71865394
N-[3-(1,3-oxazol-5-yl)phenyl]-3-(2-oxopyrrolidin-1-yl)benzamide
CID 122132406
3-(dimethylsulfamoyl)-4,5-dimethyl-N-[3-(1,3-oxazol-5-yl)phenyl]benzamide
CID 55833213
3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]but-2-enamide
CID 47353684
2-bromo-N-[3-(1,3-oxazol-5-yl)phenyl]acetamide
CID 63678754
4-amino-1-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pyrrole-2-carboxamide
CID 61102969
3-iodo-N-[4-(1,3-oxazol-5-yl)phenyl]benzamide
CID 60810765
5-chloro-N-[3-(1,3-oxazol-5-yl)phenyl]thiophene-2-carboxamide
CID 47265686
2-chloro-N-[3-(1,3-oxazol-5-yl)phenyl]pyridine-3-carboxamide
CID 61041502
N-[3-(1,3-oxazol-5-yl)phenyl]-4-oxo-1H-pyridine-3-carboxamide
CID 103337290
N-(3-acetamidophenyl)-3-methylbenzamide
CID 766081

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]benzamide?
The IUPAC name of 3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]benzamide (CID 47051399) is 3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]benzamide.
What is the SMILES notation for 3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]benzamide?
The canonical SMILES for 3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]benzamide is Cc1cccc(C(=O)Nc2cccc(-c3cnco3)c2)c1.
What is the InChIKey of 3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]benzamide?
The InChIKey is PQZYZBGGANCSQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O2/c1-12-4-2-6-14(8-12)17(20)19-15-7-3-5-13(9-15)16-10-18-11-21-16/h2-11H,1H3,(H,19,20).
What are the key properties of 3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]benzamide?
3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]benzamide has a molecular weight of 278.31 g/mol, XLogP of 3.90, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]benzamide is sourced from PubChem (CID 47051399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).