N-(2-methylpyrazol-3-yl)-5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carboxamide

C11H14N6O2 — CID 104970897

IUPACN-(2-methylpyrazol-3-yl)-5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carboxamide
SMILESCn1nccc1NC(=O)c1noc(C2CCCN2)n1
InChIInChI=1S/C11H14N6O2/c1-17-8(4-6-13-17)14-10(18)9-15-11(19-16-9)7-3-2-5-12-7/h4,6-7,12H,2-3,5H2,1H3,(H,14,18)
InChIKeyOZWGRYWAKHLSDJ-UHFFFAOYSA-N
MW262.27 g/mol
LogP0.48
Rot. Bonds3

About N-(2-methylpyrazol-3-yl)-5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carboxamide

N-(2-methylpyrazol-3-yl)-5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carboxamide (PubChem CID 104970897) has the molecular formula C11H14N6O2 and a molecular weight of 262.27 g/mol. Its IUPAC name is N-(2-methylpyrazol-3-yl)-5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carboxamide.

Molecular Properties

Compound NameN-(2-methylpyrazol-3-yl)-5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carboxamide
PubChem CID104970897
Molecular FormulaC11H14N6O2
Molecular Weight262.27 g/mol
Exact Mass262.12
IUPAC NameN-(2-methylpyrazol-3-yl)-5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carboxamide
SMILESCn1nccc1NC(=O)c1noc(C2CCCN2)n1
InChIInChI=1S/C11H14N6O2/c1-17-8(4-6-13-17)14-10(18)9-15-11(19-16-9)7-3-2-5-12-7/h4,6-7,12H,2-3,5H2,1H3,(H,14,18)
InChIKeyOZWGRYWAKHLSDJ-UHFFFAOYSA-N
XLogP0.48
TPSA97.87 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.27
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylpyrazol-3-yl)-5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carboxamide?
The IUPAC name of N-(2-methylpyrazol-3-yl)-5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carboxamide (CID 104970897) is N-(2-methylpyrazol-3-yl)-5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carboxamide.
What is the SMILES notation for N-(2-methylpyrazol-3-yl)-5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carboxamide?
The canonical SMILES for N-(2-methylpyrazol-3-yl)-5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carboxamide is Cn1nccc1NC(=O)c1noc(C2CCCN2)n1.
What is the InChIKey of N-(2-methylpyrazol-3-yl)-5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carboxamide?
The InChIKey is OZWGRYWAKHLSDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N6O2/c1-17-8(4-6-13-17)14-10(18)9-15-11(19-16-9)7-3-2-5-12-7/h4,6-7,12H,2-3,5H2,1H3,(H,14,18).
What are the key properties of N-(2-methylpyrazol-3-yl)-5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carboxamide?
N-(2-methylpyrazol-3-yl)-5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carboxamide has a molecular weight of 262.27 g/mol, XLogP of 0.48, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpyrazol-3-yl)-5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carboxamide is sourced from PubChem (CID 104970897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).