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

C15H14N4O2 — CID 3240282

IUPAC5-methyl-N-(5-methyl-2-phenylpyrazol-3-yl)-1,2-oxazole-3-carboxamide
SMILESCc1cc(NC(=O)c2cc(C)on2)n(-c2ccccc2)n1
InChIInChI=1S/C15H14N4O2/c1-10-8-14(16-15(20)13-9-11(2)21-18-13)19(17-10)12-6-4-3-5-7-12/h3-9H,1-2H3,(H,16,20)
InChIKeyBWDWMLAVEJYMCR-UHFFFAOYSA-N
MW282.30 g/mol
LogP2.73
Rot. Bonds3

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

5-methyl-N-(5-methyl-2-phenylpyrazol-3-yl)-1,2-oxazole-3-carboxamide (PubChem CID 3240282) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is 5-methyl-N-(5-methyl-2-phenylpyrazol-3-yl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(5-methyl-2-phenylpyrazol-3-yl)-1,2-oxazole-3-carboxamide
PubChem CID3240282
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC Name5-methyl-N-(5-methyl-2-phenylpyrazol-3-yl)-1,2-oxazole-3-carboxamide
SMILESCc1cc(NC(=O)c2cc(C)on2)n(-c2ccccc2)n1
InChIInChI=1S/C15H14N4O2/c1-10-8-14(16-15(20)13-9-11(2)21-18-13)19(17-10)12-6-4-3-5-7-12/h3-9H,1-2H3,(H,16,20)
InChIKeyBWDWMLAVEJYMCR-UHFFFAOYSA-N
XLogP2.73
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(5-methyl-2-phenylpyrazol-3-yl)-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-methyl-N-(5-methyl-2-phenylpyrazol-3-yl)-1,2-oxazole-3-carboxamide (CID 3240282) is 5-methyl-N-(5-methyl-2-phenylpyrazol-3-yl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-methyl-N-(5-methyl-2-phenylpyrazol-3-yl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-methyl-N-(5-methyl-2-phenylpyrazol-3-yl)-1,2-oxazole-3-carboxamide is Cc1cc(NC(=O)c2cc(C)on2)n(-c2ccccc2)n1.
What is the InChIKey of 5-methyl-N-(5-methyl-2-phenylpyrazol-3-yl)-1,2-oxazole-3-carboxamide?
The InChIKey is BWDWMLAVEJYMCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2/c1-10-8-14(16-15(20)13-9-11(2)21-18-13)19(17-10)12-6-4-3-5-7-12/h3-9H,1-2H3,(H,16,20).
What are the key properties of 5-methyl-N-(5-methyl-2-phenylpyrazol-3-yl)-1,2-oxazole-3-carboxamide?
5-methyl-N-(5-methyl-2-phenylpyrazol-3-yl)-1,2-oxazole-3-carboxamide has a molecular weight of 282.30 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(5-methyl-2-phenylpyrazol-3-yl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 3240282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).