5-cyclopropyl-3-(5-methyl-1H-pyrazol-4-yl)-1,2,4-oxadiazole

C9H10N4O — CID 166252740

IUPAC5-cyclopropyl-3-(5-methyl-1H-pyrazol-4-yl)-1,2,4-oxadiazole
SMILESCc1[nH]ncc1-c1noc(C2CC2)n1
InChIInChI=1S/C9H10N4O/c1-5-7(4-10-12-5)8-11-9(14-13-8)6-2-3-6/h4,6H,2-3H2,1H3,(H,10,12)
InChIKeyWRMYMYPTBYTHNF-UHFFFAOYSA-N
MW190.21 g/mol
LogP1.65
Rot. Bonds2

About 5-cyclopropyl-3-(5-methyl-1H-pyrazol-4-yl)-1,2,4-oxadiazole

5-cyclopropyl-3-(5-methyl-1H-pyrazol-4-yl)-1,2,4-oxadiazole (PubChem CID 166252740) has the molecular formula C9H10N4O and a molecular weight of 190.21 g/mol. Its IUPAC name is 5-cyclopropyl-3-(5-methyl-1H-pyrazol-4-yl)-1,2,4-oxadiazole.

Molecular Properties

Compound Name5-cyclopropyl-3-(5-methyl-1H-pyrazol-4-yl)-1,2,4-oxadiazole
PubChem CID166252740
Molecular FormulaC9H10N4O
Molecular Weight190.21 g/mol
Exact Mass190.09
IUPAC Name5-cyclopropyl-3-(5-methyl-1H-pyrazol-4-yl)-1,2,4-oxadiazole
SMILESCc1[nH]ncc1-c1noc(C2CC2)n1
InChIInChI=1S/C9H10N4O/c1-5-7(4-10-12-5)8-11-9(14-13-8)6-2-3-6/h4,6H,2-3H2,1H3,(H,10,12)
InChIKeyWRMYMYPTBYTHNF-UHFFFAOYSA-N
XLogP1.65
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.21
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-3-(5-methyl-1H-pyrazol-4-yl)-1,2,4-oxadiazole?
The IUPAC name of 5-cyclopropyl-3-(5-methyl-1H-pyrazol-4-yl)-1,2,4-oxadiazole (CID 166252740) is 5-cyclopropyl-3-(5-methyl-1H-pyrazol-4-yl)-1,2,4-oxadiazole.
What is the SMILES notation for 5-cyclopropyl-3-(5-methyl-1H-pyrazol-4-yl)-1,2,4-oxadiazole?
The canonical SMILES for 5-cyclopropyl-3-(5-methyl-1H-pyrazol-4-yl)-1,2,4-oxadiazole is Cc1[nH]ncc1-c1noc(C2CC2)n1.
What is the InChIKey of 5-cyclopropyl-3-(5-methyl-1H-pyrazol-4-yl)-1,2,4-oxadiazole?
The InChIKey is WRMYMYPTBYTHNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O/c1-5-7(4-10-12-5)8-11-9(14-13-8)6-2-3-6/h4,6H,2-3H2,1H3,(H,10,12).
What are the key properties of 5-cyclopropyl-3-(5-methyl-1H-pyrazol-4-yl)-1,2,4-oxadiazole?
5-cyclopropyl-3-(5-methyl-1H-pyrazol-4-yl)-1,2,4-oxadiazole has a molecular weight of 190.21 g/mol, XLogP of 1.65, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-3-(5-methyl-1H-pyrazol-4-yl)-1,2,4-oxadiazole is sourced from PubChem (CID 166252740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).