N-[1-[3-(2-cyclopropyl-4-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl]-2-propan-2-ylpyrazole-3-carboxamide

C19H22N6O2 — CID 169079675

About N-[1-[3-(2-cyclopropyl-4-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl]-2-propan-2-ylpyrazole-3-carboxamide

N-[1-[3-(2-cyclopropyl-4-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl]-2-propan-2-ylpyrazole-3-carboxamide (PubChem CID 169079675) has the molecular formula C19H22N6O2 and a molecular weight of 366.43 g/mol. Its IUPAC name is N-[1-[3-(2-cyclopropyl-4-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl]-2-propan-2-ylpyrazole-3-carboxamide.

Molecular Properties

• Compound Name: N-[1-[3-(2-cyclopropyl-4-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl]-2-propan-2-ylpyrazole-3-carboxamide
• PubChem CID: 169079675
• Molecular Formula: C19H22N6O2
• Molecular Weight: 366.43 g/mol
• Exact Mass: 366.18
• IUPAC Name: N-[1-[3-(2-cyclopropyl-4-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl]-2-propan-2-ylpyrazole-3-carboxamide
• SMILES: CC(NC(=O)c1ccnn1C(C)C)c1nc(-c2ccnc(C3CC3)c2)no1
• InChI: InChI=1S/C19H22N6O2/c1-11(2)25-16(7-9-21-25)18(26)22-12(3)19-23-17(24-27-19)14-6-8-20-15(10-14)13-4-5-13/h6-13H,4-5H2,1-3H3,(H,22,26)
• InChIKey: RXAQXBIODIAAGK-UHFFFAOYSA-N
• XLogP: 3.28
• TPSA: 98.73 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 6
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	366.43
LogP ≤ 5	3.28
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N-[1-[3-(2-cyclopropyl-4-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl]-2-propan-2-ylpyrazole-3-carboxamide?

The IUPAC name of N-[1-[3-(2-cyclopropyl-4-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl]-2-propan-2-ylpyrazole-3-carboxamide (CID 169079675) is N-[1-[3-(2-cyclopropyl-4-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl]-2-propan-2-ylpyrazole-3-carboxamide.

What is the SMILES notation for N-[1-[3-(2-cyclopropyl-4-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl]-2-propan-2-ylpyrazole-3-carboxamide?

The canonical SMILES for N-[1-[3-(2-cyclopropyl-4-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl]-2-propan-2-ylpyrazole-3-carboxamide is CC(NC(=O)c1ccnn1C(C)C)c1nc(-c2ccnc(C3CC3)c2)no1.

What is the InChIKey of N-[1-[3-(2-cyclopropyl-4-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl]-2-propan-2-ylpyrazole-3-carboxamide?

The InChIKey is RXAQXBIODIAAGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6O2/c1-11(2)25-16(7-9-21-25)18(26)22-12(3)19-23-17(24-27-19)14-6-8-20-15(10-14)13-4-5-13/h6-13H,4-5H2,1-3H3,(H,22,26).

What are the key properties of N-[1-[3-(2-cyclopropyl-4-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl]-2-propan-2-ylpyrazole-3-carboxamide?

N-[1-[3-(2-cyclopropyl-4-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl]-2-propan-2-ylpyrazole-3-carboxamide has a molecular weight of 366.43 g/mol, XLogP of 3.28, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-[1-[3-(2-cyclopropyl-4-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl]-2-propan-2-ylpyrazole-3-carboxamide is sourced from PubChem (CID 169079675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).