3-cyclopropyl-5-(4-methylpyrrolidin-3-yl)-1,2,4-oxadiazole

C10H15N3O — CID 63721270

IUPAC3-cyclopropyl-5-(4-methylpyrrolidin-3-yl)-1,2,4-oxadiazole
SMILESCC1CNCC1c1nc(C2CC2)no1
InChIInChI=1S/C10H15N3O/c1-6-4-11-5-8(6)10-12-9(13-14-10)7-2-3-7/h6-8,11H,2-5H2,1H3
InChIKeyAQDSTLCVGXZXDI-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.27
Rot. Bonds2

About 3-cyclopropyl-5-(4-methylpyrrolidin-3-yl)-1,2,4-oxadiazole

3-cyclopropyl-5-(4-methylpyrrolidin-3-yl)-1,2,4-oxadiazole (PubChem CID 63721270) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 3-cyclopropyl-5-(4-methylpyrrolidin-3-yl)-1,2,4-oxadiazole.

Molecular Properties

Compound Name3-cyclopropyl-5-(4-methylpyrrolidin-3-yl)-1,2,4-oxadiazole
PubChem CID63721270
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name3-cyclopropyl-5-(4-methylpyrrolidin-3-yl)-1,2,4-oxadiazole
SMILESCC1CNCC1c1nc(C2CC2)no1
InChIInChI=1S/C10H15N3O/c1-6-4-11-5-8(6)10-12-9(13-14-10)7-2-3-7/h6-8,11H,2-5H2,1H3
InChIKeyAQDSTLCVGXZXDI-UHFFFAOYSA-N
XLogP1.27
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-5-(4-methylpyrrolidin-3-yl)-1,2,4-oxadiazole?
The IUPAC name of 3-cyclopropyl-5-(4-methylpyrrolidin-3-yl)-1,2,4-oxadiazole (CID 63721270) is 3-cyclopropyl-5-(4-methylpyrrolidin-3-yl)-1,2,4-oxadiazole.
What is the SMILES notation for 3-cyclopropyl-5-(4-methylpyrrolidin-3-yl)-1,2,4-oxadiazole?
The canonical SMILES for 3-cyclopropyl-5-(4-methylpyrrolidin-3-yl)-1,2,4-oxadiazole is CC1CNCC1c1nc(C2CC2)no1.
What is the InChIKey of 3-cyclopropyl-5-(4-methylpyrrolidin-3-yl)-1,2,4-oxadiazole?
The InChIKey is AQDSTLCVGXZXDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-6-4-11-5-8(6)10-12-9(13-14-10)7-2-3-7/h6-8,11H,2-5H2,1H3.
What are the key properties of 3-cyclopropyl-5-(4-methylpyrrolidin-3-yl)-1,2,4-oxadiazole?
3-cyclopropyl-5-(4-methylpyrrolidin-3-yl)-1,2,4-oxadiazole has a molecular weight of 193.25 g/mol, XLogP of 1.27, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-5-(4-methylpyrrolidin-3-yl)-1,2,4-oxadiazole is sourced from PubChem (CID 63721270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).