5-phenyl-N-[1-(pyridin-2-ylmethyl)pyrazol-4-yl]-1,2-oxazole-3-carboxamide

C19H15N5O2 — CID 156596082

IUPAC5-phenyl-N-[1-(pyridin-2-ylmethyl)pyrazol-4-yl]-1,2-oxazole-3-carboxamide
SMILESO=C(Nc1cnn(Cc2ccccn2)c1)c1cc(-c2ccccc2)on1
InChIInChI=1S/C19H15N5O2/c25-19(17-10-18(26-23-17)14-6-2-1-3-7-14)22-16-11-21-24(13-16)12-15-8-4-5-9-20-15/h1-11,13H,12H2,(H,22,25)
InChIKeyLJGWWOHBKFIPFO-UHFFFAOYSA-N
MW345.36 g/mol
LogP3.23
Rot. Bonds5

About 5-phenyl-N-[1-(pyridin-2-ylmethyl)pyrazol-4-yl]-1,2-oxazole-3-carboxamide

5-phenyl-N-[1-(pyridin-2-ylmethyl)pyrazol-4-yl]-1,2-oxazole-3-carboxamide (PubChem CID 156596082) has the molecular formula C19H15N5O2 and a molecular weight of 345.36 g/mol. Its IUPAC name is 5-phenyl-N-[1-(pyridin-2-ylmethyl)pyrazol-4-yl]-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-phenyl-N-[1-(pyridin-2-ylmethyl)pyrazol-4-yl]-1,2-oxazole-3-carboxamide
PubChem CID156596082
Molecular FormulaC19H15N5O2
Molecular Weight345.36 g/mol
Exact Mass345.12
IUPAC Name5-phenyl-N-[1-(pyridin-2-ylmethyl)pyrazol-4-yl]-1,2-oxazole-3-carboxamide
SMILESO=C(Nc1cnn(Cc2ccccn2)c1)c1cc(-c2ccccc2)on1
InChIInChI=1S/C19H15N5O2/c25-19(17-10-18(26-23-17)14-6-2-1-3-7-14)22-16-11-21-24(13-16)12-15-8-4-5-9-20-15/h1-11,13H,12H2,(H,22,25)
InChIKeyLJGWWOHBKFIPFO-UHFFFAOYSA-N
XLogP3.23
TPSA85.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.36
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

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5-(4-chlorophenyl)-N-pyridin-3-ylisoxazole-3-carboxamide
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5-cyclopropyl-N-[1-(2-methylbenzyl)-1H-pyrazol-4-yl]isoxazole-3-carboxamide
CID 16188847
N-(4-isoxazol-5-ylphenyl)-3-(3-methyl-1H-pyrazol-1-yl)propanamide
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5-phenyl-N-(3-pyridinylmethyl)-3-isoxazolecarboxamide
CID 973868
N-[1-(1-adamantyl)-1H-pyrazol-4-yl]-5-phenyl-3-isoxazolecarboxamide
CID 2962287
N-(1-((3,5-dimethylisoxazol-4-yl)methyl)-1H-pyrazol-4-yl)-3-methoxybenzamide
CID 25206166
US10889564, Example 13
CID 26396555
[3-(2-Hydroxyphenyl)-5-pyridin-3-yl-3,4-dihydropyrazol-2-yl]-(5-phenyl-1,2-oxazol-3-yl)methanone
CID 54580136
N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-phenylacetamide
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N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-3-phenylpropanamide
CID 57944900

Frequently Asked Questions

What is the IUPAC name of 5-phenyl-N-[1-(pyridin-2-ylmethyl)pyrazol-4-yl]-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-phenyl-N-[1-(pyridin-2-ylmethyl)pyrazol-4-yl]-1,2-oxazole-3-carboxamide (CID 156596082) is 5-phenyl-N-[1-(pyridin-2-ylmethyl)pyrazol-4-yl]-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-phenyl-N-[1-(pyridin-2-ylmethyl)pyrazol-4-yl]-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-phenyl-N-[1-(pyridin-2-ylmethyl)pyrazol-4-yl]-1,2-oxazole-3-carboxamide is O=C(Nc1cnn(Cc2ccccn2)c1)c1cc(-c2ccccc2)on1.
What is the InChIKey of 5-phenyl-N-[1-(pyridin-2-ylmethyl)pyrazol-4-yl]-1,2-oxazole-3-carboxamide?
The InChIKey is LJGWWOHBKFIPFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N5O2/c25-19(17-10-18(26-23-17)14-6-2-1-3-7-14)22-16-11-21-24(13-16)12-15-8-4-5-9-20-15/h1-11,13H,12H2,(H,22,25).
What are the key properties of 5-phenyl-N-[1-(pyridin-2-ylmethyl)pyrazol-4-yl]-1,2-oxazole-3-carboxamide?
5-phenyl-N-[1-(pyridin-2-ylmethyl)pyrazol-4-yl]-1,2-oxazole-3-carboxamide has a molecular weight of 345.36 g/mol, XLogP of 3.23, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-N-[1-(pyridin-2-ylmethyl)pyrazol-4-yl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 156596082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).