5-(2-aminocyclopentyl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide

C10H16N4O2 — CID 102791399

IUPAC5-(2-aminocyclopentyl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide
SMILESCCNC(=O)c1noc(C2CCCC2N)n1
InChIInChI=1S/C10H16N4O2/c1-2-12-9(15)8-13-10(16-14-8)6-4-3-5-7(6)11/h6-7H,2-5,11H2,1H3,(H,12,15)
InChIKeyJSXUJORBFWBMHP-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.41
Rot. Bonds3

About 5-(2-aminocyclopentyl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide

5-(2-aminocyclopentyl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide (PubChem CID 102791399) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 5-(2-aminocyclopentyl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide.

Molecular Properties

Compound Name5-(2-aminocyclopentyl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide
PubChem CID102791399
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name5-(2-aminocyclopentyl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide
SMILESCCNC(=O)c1noc(C2CCCC2N)n1
InChIInChI=1S/C10H16N4O2/c1-2-12-9(15)8-13-10(16-14-8)6-4-3-5-7(6)11/h6-7H,2-5,11H2,1H3,(H,12,15)
InChIKeyJSXUJORBFWBMHP-UHFFFAOYSA-N
XLogP0.41
TPSA94.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(2-aminocyclopentyl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide?
The IUPAC name of 5-(2-aminocyclopentyl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide (CID 102791399) is 5-(2-aminocyclopentyl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide.
What is the SMILES notation for 5-(2-aminocyclopentyl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide?
The canonical SMILES for 5-(2-aminocyclopentyl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide is CCNC(=O)c1noc(C2CCCC2N)n1.
What is the InChIKey of 5-(2-aminocyclopentyl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide?
The InChIKey is JSXUJORBFWBMHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-2-12-9(15)8-13-10(16-14-8)6-4-3-5-7(6)11/h6-7H,2-5,11H2,1H3,(H,12,15).
What are the key properties of 5-(2-aminocyclopentyl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide?
5-(2-aminocyclopentyl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide has a molecular weight of 224.26 g/mol, XLogP of 0.41, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminocyclopentyl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide is sourced from PubChem (CID 102791399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).