N-(5-methyl-2-phenylpyrazol-3-yl)-5-phenyl-1,2-oxazole-3-carboxamide

C20H16N4O2 — CID 973867

IUPACN-(5-methyl-2-phenylpyrazol-3-yl)-5-phenyl-1,2-oxazole-3-carboxamide
SMILESCc1cc(NC(=O)c2cc(-c3ccccc3)on2)n(-c2ccccc2)n1
InChIInChI=1S/C20H16N4O2/c1-14-12-19(24(22-14)16-10-6-3-7-11-16)21-20(25)17-13-18(26-23-17)15-8-4-2-5-9-15/h2-13H,1H3,(H,21,25)
InChIKeyANJOIWRLBINDGZ-UHFFFAOYSA-N
MW344.37 g/mol
LogP4.09
Rot. Bonds4

About N-(5-methyl-2-phenylpyrazol-3-yl)-5-phenyl-1,2-oxazole-3-carboxamide

N-(5-methyl-2-phenylpyrazol-3-yl)-5-phenyl-1,2-oxazole-3-carboxamide (PubChem CID 973867) has the molecular formula C20H16N4O2 and a molecular weight of 344.37 g/mol. Its IUPAC name is N-(5-methyl-2-phenylpyrazol-3-yl)-5-phenyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(5-methyl-2-phenylpyrazol-3-yl)-5-phenyl-1,2-oxazole-3-carboxamide
PubChem CID973867
Molecular FormulaC20H16N4O2
Molecular Weight344.37 g/mol
Exact Mass344.13
IUPAC NameN-(5-methyl-2-phenylpyrazol-3-yl)-5-phenyl-1,2-oxazole-3-carboxamide
SMILESCc1cc(NC(=O)c2cc(-c3ccccc3)on2)n(-c2ccccc2)n1
InChIInChI=1S/C20H16N4O2/c1-14-12-19(24(22-14)16-10-6-3-7-11-16)21-20(25)17-13-18(26-23-17)15-8-4-2-5-9-15/h2-13H,1H3,(H,21,25)
InChIKeyANJOIWRLBINDGZ-UHFFFAOYSA-N
XLogP4.09
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.37
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-2-phenylpyrazol-3-yl)-5-phenyl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(5-methyl-2-phenylpyrazol-3-yl)-5-phenyl-1,2-oxazole-3-carboxamide (CID 973867) is N-(5-methyl-2-phenylpyrazol-3-yl)-5-phenyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(5-methyl-2-phenylpyrazol-3-yl)-5-phenyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(5-methyl-2-phenylpyrazol-3-yl)-5-phenyl-1,2-oxazole-3-carboxamide is Cc1cc(NC(=O)c2cc(-c3ccccc3)on2)n(-c2ccccc2)n1.
What is the InChIKey of N-(5-methyl-2-phenylpyrazol-3-yl)-5-phenyl-1,2-oxazole-3-carboxamide?
The InChIKey is ANJOIWRLBINDGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4O2/c1-14-12-19(24(22-14)16-10-6-3-7-11-16)21-20(25)17-13-18(26-23-17)15-8-4-2-5-9-15/h2-13H,1H3,(H,21,25).
What are the key properties of N-(5-methyl-2-phenylpyrazol-3-yl)-5-phenyl-1,2-oxazole-3-carboxamide?
N-(5-methyl-2-phenylpyrazol-3-yl)-5-phenyl-1,2-oxazole-3-carboxamide has a molecular weight of 344.37 g/mol, XLogP of 4.09, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-2-phenylpyrazol-3-yl)-5-phenyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 973867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).