6-chloro-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)pyridine-2-carboxamide

C11H9ClN4O2 — CID 62234548

IUPAC6-chloro-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)pyridine-2-carboxamide
SMILESO=C(Nc1nnc(C2CC2)o1)c1cccc(Cl)n1
InChIInChI=1S/C11H9ClN4O2/c12-8-3-1-2-7(13-8)9(17)14-11-16-15-10(18-11)6-4-5-6/h1-3,6H,4-5H2,(H,14,16,17)
InChIKeyJSWHWTZGVDWZCS-UHFFFAOYSA-N
MW264.67 g/mol
LogP2.25
Rot. Bonds3

About 6-chloro-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)pyridine-2-carboxamide

6-chloro-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)pyridine-2-carboxamide (PubChem CID 62234548) has the molecular formula C11H9ClN4O2 and a molecular weight of 264.67 g/mol. Its IUPAC name is 6-chloro-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)pyridine-2-carboxamide
PubChem CID62234548
Molecular FormulaC11H9ClN4O2
Molecular Weight264.67 g/mol
Exact Mass264.04
IUPAC Name6-chloro-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)pyridine-2-carboxamide
SMILESO=C(Nc1nnc(C2CC2)o1)c1cccc(Cl)n1
InChIInChI=1S/C11H9ClN4O2/c12-8-3-1-2-7(13-8)9(17)14-11-16-15-10(18-11)6-4-5-6/h1-3,6H,4-5H2,(H,14,16,17)
InChIKeyJSWHWTZGVDWZCS-UHFFFAOYSA-N
XLogP2.25
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.67
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)pyridine-2-carboxamide?
The IUPAC name of 6-chloro-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)pyridine-2-carboxamide (CID 62234548) is 6-chloro-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)pyridine-2-carboxamide.
What is the SMILES notation for 6-chloro-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)pyridine-2-carboxamide?
The canonical SMILES for 6-chloro-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)pyridine-2-carboxamide is O=C(Nc1nnc(C2CC2)o1)c1cccc(Cl)n1.
What is the InChIKey of 6-chloro-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)pyridine-2-carboxamide?
The InChIKey is JSWHWTZGVDWZCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN4O2/c12-8-3-1-2-7(13-8)9(17)14-11-16-15-10(18-11)6-4-5-6/h1-3,6H,4-5H2,(H,14,16,17).
What are the key properties of 6-chloro-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)pyridine-2-carboxamide?
6-chloro-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)pyridine-2-carboxamide has a molecular weight of 264.67 g/mol, XLogP of 2.25, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)pyridine-2-carboxamide is sourced from PubChem (CID 62234548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).