5-(4-methylphenyl)-N-(2-phenylpropyl)-1,2-oxazole-4-carboxamide

C20H20N2O2 — CID 59170277

IUPAC5-(4-methylphenyl)-N-(2-phenylpropyl)-1,2-oxazole-4-carboxamide
SMILESCc1ccc(-c2oncc2C(=O)NCC(C)c2ccccc2)cc1
InChIInChI=1S/C20H20N2O2/c1-14-8-10-17(11-9-14)19-18(13-22-24-19)20(23)21-12-15(2)16-6-4-3-5-7-16/h3-11,13,15H,12H2,1-2H3,(H,21,23)
InChIKeyOIUYHQPOPYYDRB-UHFFFAOYSA-N
MW320.39 g/mol
LogP4.18
Rot. Bonds5

About 5-(4-methylphenyl)-N-(2-phenylpropyl)-1,2-oxazole-4-carboxamide

5-(4-methylphenyl)-N-(2-phenylpropyl)-1,2-oxazole-4-carboxamide (PubChem CID 59170277) has the molecular formula C20H20N2O2 and a molecular weight of 320.39 g/mol. Its IUPAC name is 5-(4-methylphenyl)-N-(2-phenylpropyl)-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound Name5-(4-methylphenyl)-N-(2-phenylpropyl)-1,2-oxazole-4-carboxamide
PubChem CID59170277
Molecular FormulaC20H20N2O2
Molecular Weight320.39 g/mol
Exact Mass320.15
IUPAC Name5-(4-methylphenyl)-N-(2-phenylpropyl)-1,2-oxazole-4-carboxamide
SMILESCc1ccc(-c2oncc2C(=O)NCC(C)c2ccccc2)cc1
InChIInChI=1S/C20H20N2O2/c1-14-8-10-17(11-9-14)19-18(13-22-24-19)20(23)21-12-15(2)16-6-4-3-5-7-16/h3-11,13,15H,12H2,1-2H3,(H,21,23)
InChIKeyOIUYHQPOPYYDRB-UHFFFAOYSA-N
XLogP4.18
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-fluorophenyl)-N-(2-methylpropyl)-1,2-oxazole-4-carboxamide
CID 110647364
4-methyl-N-[(2R)-2-phenylpropyl]benzamide
CID 9302175
3-(4-methylphenyl)-N-(2-phenylpropyl)-2,1-benzoxazole-5-carboxamide
CID 22575656
2,4-dimethyl-N-[(2S)-2-phenylpropyl]benzamide
CID 26778990
2-hydroxy-4-methyl-N-(2-phenylpropyl)benzamide
CID 47098893
N-[1-(4-fluorophenyl)ethyl]-5-(4-methylphenyl)-1,2-oxazole-4-carboxamide
CID 59170223
N-[2-(4-chlorophenyl)ethyl]-5-(4-methylphenyl)-1,2-oxazole-4-carboxamide
CID 59170194
bicyclo[2.2.0]hexa-1,3,5-triene;N-(2-phenylpropyl)acetamide
CID 175348879
5-methyl-N-(2-phenylpropyl)pyrazine-2-carboxamide
CID 18209356
4-methyl-N-[2-oxo-2-(2-phenylpropylamino)ethyl]benzamide
CID 17400864
2-(ethylamino)-N-(2-phenylpropyl)benzamide
CID 63107799
3-hydrazinyl-N-(2-phenylpropyl)pyridine-4-carboxamide
CID 105072451

Frequently Asked Questions

What is the IUPAC name of 5-(4-methylphenyl)-N-(2-phenylpropyl)-1,2-oxazole-4-carboxamide?
The IUPAC name of 5-(4-methylphenyl)-N-(2-phenylpropyl)-1,2-oxazole-4-carboxamide (CID 59170277) is 5-(4-methylphenyl)-N-(2-phenylpropyl)-1,2-oxazole-4-carboxamide.
What is the SMILES notation for 5-(4-methylphenyl)-N-(2-phenylpropyl)-1,2-oxazole-4-carboxamide?
The canonical SMILES for 5-(4-methylphenyl)-N-(2-phenylpropyl)-1,2-oxazole-4-carboxamide is Cc1ccc(-c2oncc2C(=O)NCC(C)c2ccccc2)cc1.
What is the InChIKey of 5-(4-methylphenyl)-N-(2-phenylpropyl)-1,2-oxazole-4-carboxamide?
The InChIKey is OIUYHQPOPYYDRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2/c1-14-8-10-17(11-9-14)19-18(13-22-24-19)20(23)21-12-15(2)16-6-4-3-5-7-16/h3-11,13,15H,12H2,1-2H3,(H,21,23).
What are the key properties of 5-(4-methylphenyl)-N-(2-phenylpropyl)-1,2-oxazole-4-carboxamide?
5-(4-methylphenyl)-N-(2-phenylpropyl)-1,2-oxazole-4-carboxamide has a molecular weight of 320.39 g/mol, XLogP of 4.18, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylphenyl)-N-(2-phenylpropyl)-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 59170277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).