5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-N-phenylpyrazole-1-carboxamide

C20H16N4O2 — CID 2745590

IUPAC5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-N-phenylpyrazole-1-carboxamide
SMILESCc1onc(-c2ccccc2)c1-c1ccnn1C(=O)Nc1ccccc1
InChIInChI=1S/C20H16N4O2/c1-14-18(19(23-26-14)15-8-4-2-5-9-15)17-12-13-21-24(17)20(25)22-16-10-6-3-7-11-16/h2-13H,1H3,(H,22,25)
InChIKeyLKFARDZNYYTYBY-UHFFFAOYSA-N
MW344.37 g/mol
LogP4.59
Rot. Bonds3

About 5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-N-phenylpyrazole-1-carboxamide

5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-N-phenylpyrazole-1-carboxamide (PubChem CID 2745590) has the molecular formula C20H16N4O2 and a molecular weight of 344.37 g/mol. Its IUPAC name is 5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-N-phenylpyrazole-1-carboxamide.

Molecular Properties

Compound Name5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-N-phenylpyrazole-1-carboxamide
PubChem CID2745590
Molecular FormulaC20H16N4O2
Molecular Weight344.37 g/mol
Exact Mass344.13
IUPAC Name5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-N-phenylpyrazole-1-carboxamide
SMILESCc1onc(-c2ccccc2)c1-c1ccnn1C(=O)Nc1ccccc1
InChIInChI=1S/C20H16N4O2/c1-14-18(19(23-26-14)15-8-4-2-5-9-15)17-12-13-21-24(17)20(25)22-16-10-6-3-7-11-16/h2-13H,1H3,(H,22,25)
InChIKeyLKFARDZNYYTYBY-UHFFFAOYSA-N
XLogP4.59
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.37
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-N-propan-2-ylpyrazole-1-carboxamide
CID 2745595
5-[3-(4-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]-N-propan-2-ylpyrazole-1-carboxamide
CID 2745572
4-(5-methyl-4-phenyl-1,2-oxazol-3-yl)benzoic acid
CID 58833412
[4-[4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)imidazol-1-yl]phenyl]carbamic acid
CID 67422146
1,3-bis(5-methyl-3-phenyl-1,2-oxazol-4-yl)urea
CID 2764630
4-formyl-N-[3-(5-methyl-3-phenyl-1,2-oxazol-4-yl)phenyl]benzamide
CID 89188391
2-[[5-ethyl-4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-1,3-thiazol-2-yl]amino]-2-oxoacetic acid
CID 21296125
(E)-3-(5-methyl-3-phenyl-1,2-oxazol-4-yl)prop-2-enoic acid
CID 170872194
N-(3-chlorophenyl)-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
CID 873609
(5-methyl-3-phenyl-1,2-oxazol-4-yl)-pyrrol-1-ylmethanone
CID 2803917
5-methyl-N-[3-(1-methylimidazol-2-yl)phenyl]-3-phenyl-1,2-oxazole-4-carboxamide
CID 60557129
5-phenylpyrazole-1-carboxylic acid
CID 175297488

Frequently Asked Questions

What is the IUPAC name of 5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-N-phenylpyrazole-1-carboxamide?
The IUPAC name of 5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-N-phenylpyrazole-1-carboxamide (CID 2745590) is 5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-N-phenylpyrazole-1-carboxamide.
What is the SMILES notation for 5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-N-phenylpyrazole-1-carboxamide?
The canonical SMILES for 5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-N-phenylpyrazole-1-carboxamide is Cc1onc(-c2ccccc2)c1-c1ccnn1C(=O)Nc1ccccc1.
What is the InChIKey of 5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-N-phenylpyrazole-1-carboxamide?
The InChIKey is LKFARDZNYYTYBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4O2/c1-14-18(19(23-26-14)15-8-4-2-5-9-15)17-12-13-21-24(17)20(25)22-16-10-6-3-7-11-16/h2-13H,1H3,(H,22,25).
What are the key properties of 5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-N-phenylpyrazole-1-carboxamide?
5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-N-phenylpyrazole-1-carboxamide has a molecular weight of 344.37 g/mol, XLogP of 4.59, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-N-phenylpyrazole-1-carboxamide is sourced from PubChem (CID 2745590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).