5-methyl-3-(2-pyrazolo[1,5-a]pyrimidin-2-yl-4-pyridinyl)-1,2,4-oxadiazole

C14H10N6O — CID 159940616

IUPAC5-methyl-3-(2-pyrazolo[1,5-a]pyrimidin-2-yl-4-pyridinyl)-1,2,4-oxadiazole
SMILESCc1nc(-c2ccnc(-c3cc4ncccn4n3)c2)no1
InChIInChI=1S/C14H10N6O/c1-9-17-14(19-21-9)10-3-5-15-11(7-10)12-8-13-16-4-2-6-20(13)18-12/h2-8H,1H3
InChIKeyRGPQVQVETNYOTM-UHFFFAOYSA-N
MW278.28 g/mol
LogP2.15
Rot. Bonds2

About 5-methyl-3-(2-pyrazolo[1,5-a]pyrimidin-2-yl-4-pyridinyl)-1,2,4-oxadiazole

5-methyl-3-(2-pyrazolo[1,5-a]pyrimidin-2-yl-4-pyridinyl)-1,2,4-oxadiazole (PubChem CID 159940616) has the molecular formula C14H10N6O and a molecular weight of 278.28 g/mol. Its IUPAC name is 5-methyl-3-(2-pyrazolo[1,5-a]pyrimidin-2-yl-4-pyridinyl)-1,2,4-oxadiazole.

Molecular Properties

Compound Name5-methyl-3-(2-pyrazolo[1,5-a]pyrimidin-2-yl-4-pyridinyl)-1,2,4-oxadiazole
PubChem CID159940616
Molecular FormulaC14H10N6O
Molecular Weight278.28 g/mol
Exact Mass278.09
IUPAC Name5-methyl-3-(2-pyrazolo[1,5-a]pyrimidin-2-yl-4-pyridinyl)-1,2,4-oxadiazole
SMILESCc1nc(-c2ccnc(-c3cc4ncccn4n3)c2)no1
InChIInChI=1S/C14H10N6O/c1-9-17-14(19-21-9)10-3-5-15-11(7-10)12-8-13-16-4-2-6-20(13)18-12/h2-8H,1H3
InChIKeyRGPQVQVETNYOTM-UHFFFAOYSA-N
XLogP2.15
TPSA82.00 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.28
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-(2-pyrazolo[1,5-a]pyrimidin-2-yl-4-pyridinyl)-1,2,4-oxadiazole?
The IUPAC name of 5-methyl-3-(2-pyrazolo[1,5-a]pyrimidin-2-yl-4-pyridinyl)-1,2,4-oxadiazole (CID 159940616) is 5-methyl-3-(2-pyrazolo[1,5-a]pyrimidin-2-yl-4-pyridinyl)-1,2,4-oxadiazole.
What is the SMILES notation for 5-methyl-3-(2-pyrazolo[1,5-a]pyrimidin-2-yl-4-pyridinyl)-1,2,4-oxadiazole?
The canonical SMILES for 5-methyl-3-(2-pyrazolo[1,5-a]pyrimidin-2-yl-4-pyridinyl)-1,2,4-oxadiazole is Cc1nc(-c2ccnc(-c3cc4ncccn4n3)c2)no1.
What is the InChIKey of 5-methyl-3-(2-pyrazolo[1,5-a]pyrimidin-2-yl-4-pyridinyl)-1,2,4-oxadiazole?
The InChIKey is RGPQVQVETNYOTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N6O/c1-9-17-14(19-21-9)10-3-5-15-11(7-10)12-8-13-16-4-2-6-20(13)18-12/h2-8H,1H3.
What are the key properties of 5-methyl-3-(2-pyrazolo[1,5-a]pyrimidin-2-yl-4-pyridinyl)-1,2,4-oxadiazole?
5-methyl-3-(2-pyrazolo[1,5-a]pyrimidin-2-yl-4-pyridinyl)-1,2,4-oxadiazole has a molecular weight of 278.28 g/mol, XLogP of 2.15, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-(2-pyrazolo[1,5-a]pyrimidin-2-yl-4-pyridinyl)-1,2,4-oxadiazole is sourced from PubChem (CID 159940616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).