3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)propanoic acid

C10H14N2O3 — CID 60922559

IUPAC3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)propanoic acid
SMILESO=C(O)CCc1nc(C2CCCC2)no1
InChIInChI=1S/C10H14N2O3/c13-9(14)6-5-8-11-10(12-15-8)7-3-1-2-4-7/h7H,1-6H2,(H,13,14)
InChIKeyYXOSVETVWIGMOW-UHFFFAOYSA-N
MW210.23 g/mol
LogP1.74
Rot. Bonds4

About 3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)propanoic acid

3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)propanoic acid (PubChem CID 60922559) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is 3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)propanoic acid.

Molecular Properties

Compound Name3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)propanoic acid
PubChem CID60922559
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Name3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)propanoic acid
SMILESO=C(O)CCc1nc(C2CCCC2)no1
InChIInChI=1S/C10H14N2O3/c13-9(14)6-5-8-11-10(12-15-8)7-3-1-2-4-7/h7H,1-6H2,(H,13,14)
InChIKeyYXOSVETVWIGMOW-UHFFFAOYSA-N
XLogP1.74
TPSA76.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)propanoic acid?
The IUPAC name of 3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)propanoic acid (CID 60922559) is 3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)propanoic acid.
What is the SMILES notation for 3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)propanoic acid?
The canonical SMILES for 3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)propanoic acid is O=C(O)CCc1nc(C2CCCC2)no1.
What is the InChIKey of 3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)propanoic acid?
The InChIKey is YXOSVETVWIGMOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3/c13-9(14)6-5-8-11-10(12-15-8)7-3-1-2-4-7/h7H,1-6H2,(H,13,14).
What are the key properties of 3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)propanoic acid?
3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)propanoic acid has a molecular weight of 210.23 g/mol, XLogP of 1.74, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)propanoic acid is sourced from PubChem (CID 60922559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).