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

C17H16N4O2 — CID 110372583

IUPAC5-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)-1-phenylpyrazole-3-carboxamide
SMILESCc1cc(NC(=O)c2cc(C3CC3)n(-c3ccccc3)n2)no1
InChIInChI=1S/C17H16N4O2/c1-11-9-16(20-23-11)18-17(22)14-10-15(12-7-8-12)21(19-14)13-5-3-2-4-6-13/h2-6,9-10,12H,7-8H2,1H3,(H,18,20,22)
InChIKeyUJFNCBNAQJJECJ-UHFFFAOYSA-N
MW308.34 g/mol
LogP3.30
Rot. Bonds4

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

5-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)-1-phenylpyrazole-3-carboxamide (PubChem CID 110372583) has the molecular formula C17H16N4O2 and a molecular weight of 308.34 g/mol. Its IUPAC name is 5-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)-1-phenylpyrazole-3-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)-1-phenylpyrazole-3-carboxamide
PubChem CID110372583
Molecular FormulaC17H16N4O2
Molecular Weight308.34 g/mol
Exact Mass308.13
IUPAC Name5-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)-1-phenylpyrazole-3-carboxamide
SMILESCc1cc(NC(=O)c2cc(C3CC3)n(-c3ccccc3)n2)no1
InChIInChI=1S/C17H16N4O2/c1-11-9-16(20-23-11)18-17(22)14-10-15(12-7-8-12)21(19-14)13-5-3-2-4-6-13/h2-6,9-10,12H,7-8H2,1H3,(H,18,20,22)
InChIKeyUJFNCBNAQJJECJ-UHFFFAOYSA-N
XLogP3.30
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.34
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-methyl-1,2-oxazol-3-yl)-6-oxo-1-phenylpyridazine-3-carboxamide
CID 31979037
N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 569560
N-(3-acetamidophenyl)-5-cyclopropyl-1-(4-fluorophenyl)pyrazole-3-carboxamide
CID 110372615
(6R)-4-methyl-N-(5-methyl-1,2-oxazol-3-yl)-3,6-diphenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide
CID 25414809
5-cyclopropyl-1-(4-methoxyphenyl)pyrazole-3-carboxylic acid
CID 82089498
5-cyclopropyl-1-(3-methylphenyl)-N-(oxolan-2-ylmethyl)pyrazole-3-carboxamide
CID 110372655
4-N-(5-methyl-1,2-oxazol-3-yl)-1-N-phenylcyclohexane-1,4-dicarboxamide
CID 109150357
1-methyl-3-(5-methyl-1,2-oxazol-3-yl)-1-(4-phenylcyclohexyl)urea
CID 51122102
2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-6-[4-(3-methylphenyl)piperazin-1-yl]pyrimidine-4-carboxamide
CID 109373111
N-(5-methyl-1,2-oxazol-3-yl)-3-phenylcyclobutane-1-carboxamide
CID 154775274
N-cyclopentyl-5-cyclopropyl-1-(3-methoxyphenyl)pyrazole-3-carboxamide
CID 110372725
5-cyclopropyl-1-(4-methoxyphenyl)-N-(2-methylpropyl)pyrazole-3-carboxamide
CID 110372681

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)-1-phenylpyrazole-3-carboxamide?
The IUPAC name of 5-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)-1-phenylpyrazole-3-carboxamide (CID 110372583) is 5-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)-1-phenylpyrazole-3-carboxamide.
What is the SMILES notation for 5-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)-1-phenylpyrazole-3-carboxamide?
The canonical SMILES for 5-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)-1-phenylpyrazole-3-carboxamide is Cc1cc(NC(=O)c2cc(C3CC3)n(-c3ccccc3)n2)no1.
What is the InChIKey of 5-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)-1-phenylpyrazole-3-carboxamide?
The InChIKey is UJFNCBNAQJJECJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O2/c1-11-9-16(20-23-11)18-17(22)14-10-15(12-7-8-12)21(19-14)13-5-3-2-4-6-13/h2-6,9-10,12H,7-8H2,1H3,(H,18,20,22).
What are the key properties of 5-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)-1-phenylpyrazole-3-carboxamide?
5-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)-1-phenylpyrazole-3-carboxamide has a molecular weight of 308.34 g/mol, XLogP of 3.30, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)-1-phenylpyrazole-3-carboxamide is sourced from PubChem (CID 110372583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).