6-chloro-N-[3-[5-[3-(trifluoromethoxy)cyclobutyl]-1,3,4-oxadiazol-2-yl]-1-bicyclo[1.1.0]butanyl]pyrazolo[1,5-a]pyridine-2-carboxamide

C19H15ClF3N5O3 — CID 142528143

About 6-chloro-N-[3-[5-[3-(trifluoromethoxy)cyclobutyl]-1,3,4-oxadiazol-2-yl]-1-bicyclo[1.1.0]butanyl]pyrazolo[1,5-a]pyridine-2-carboxamide

6-chloro-N-[3-[5-[3-(trifluoromethoxy)cyclobutyl]-1,3,4-oxadiazol-2-yl]-1-bicyclo[1.1.0]butanyl]pyrazolo[1,5-a]pyridine-2-carboxamide (PubChem CID 142528143) has the molecular formula C19H15ClF3N5O3 and a molecular weight of 453.81 g/mol. Its IUPAC name is 6-chloro-N-[3-[5-[3-(trifluoromethoxy)cyclobutyl]-1,3,4-oxadiazol-2-yl]-1-bicyclo[1.1.0]butanyl]pyrazolo[1,5-a]pyridine-2-carboxamide.

Molecular Properties

• Compound Name: 6-chloro-N-[3-[5-[3-(trifluoromethoxy)cyclobutyl]-1,3,4-oxadiazol-2-yl]-1-bicyclo[1.1.0]butanyl]pyrazolo[1,5-a]pyridine-2-carboxamide
• PubChem CID: 142528143
• Molecular Formula: C19H15ClF3N5O3
• Molecular Weight: 453.81 g/mol
• Exact Mass: 453.08
• IUPAC Name: 6-chloro-N-[3-[5-[3-(trifluoromethoxy)cyclobutyl]-1,3,4-oxadiazol-2-yl]-1-bicyclo[1.1.0]butanyl]pyrazolo[1,5-a]pyridine-2-carboxamide
• SMILES: O=C(NC12CC1(c1nnc(C3CC(OC(F)(F)F)C3)o1)C2)c1cc2ccc(Cl)cn2n1
• InChI: InChI=1S/C19H15ClF3N5O3/c20-10-1-2-11-5-13(27-28(11)6-10)14(29)24-18-7-17(18,8-18)16-26-25-15(30-16)9-3-12(4-9)31-19(21,22)23/h1-2,5-6,9,12H,3-4,7-8H2,(H,24,29)
• InChIKey: GXVVKAGUOTUWSE-UHFFFAOYSA-N
• XLogP: 3.37
• TPSA: 94.55 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 5
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	453.81
LogP ≤ 5	3.37
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[3-[5-[3-(trifluoromethoxy)cyclobutyl]-1,3,4-oxadiazol-2-yl]-1-bicyclo[1.1.0]butanyl]pyrazolo[1,5-a]pyridine-2-carboxamide?

The IUPAC name of 6-chloro-N-[3-[5-[3-(trifluoromethoxy)cyclobutyl]-1,3,4-oxadiazol-2-yl]-1-bicyclo[1.1.0]butanyl]pyrazolo[1,5-a]pyridine-2-carboxamide (CID 142528143) is 6-chloro-N-[3-[5-[3-(trifluoromethoxy)cyclobutyl]-1,3,4-oxadiazol-2-yl]-1-bicyclo[1.1.0]butanyl]pyrazolo[1,5-a]pyridine-2-carboxamide.

What is the SMILES notation for 6-chloro-N-[3-[5-[3-(trifluoromethoxy)cyclobutyl]-1,3,4-oxadiazol-2-yl]-1-bicyclo[1.1.0]butanyl]pyrazolo[1,5-a]pyridine-2-carboxamide?

The canonical SMILES for 6-chloro-N-[3-[5-[3-(trifluoromethoxy)cyclobutyl]-1,3,4-oxadiazol-2-yl]-1-bicyclo[1.1.0]butanyl]pyrazolo[1,5-a]pyridine-2-carboxamide is O=C(NC12CC1(c1nnc(C3CC(OC(F)(F)F)C3)o1)C2)c1cc2ccc(Cl)cn2n1.

What is the InChIKey of 6-chloro-N-[3-[5-[3-(trifluoromethoxy)cyclobutyl]-1,3,4-oxadiazol-2-yl]-1-bicyclo[1.1.0]butanyl]pyrazolo[1,5-a]pyridine-2-carboxamide?

The InChIKey is GXVVKAGUOTUWSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClF3N5O3/c20-10-1-2-11-5-13(27-28(11)6-10)14(29)24-18-7-17(18,8-18)16-26-25-15(30-16)9-3-12(4-9)31-19(21,22)23/h1-2,5-6,9,12H,3-4,7-8H2,(H,24,29).

What are the key properties of 6-chloro-N-[3-[5-[3-(trifluoromethoxy)cyclobutyl]-1,3,4-oxadiazol-2-yl]-1-bicyclo[1.1.0]butanyl]pyrazolo[1,5-a]pyridine-2-carboxamide?

6-chloro-N-[3-[5-[3-(trifluoromethoxy)cyclobutyl]-1,3,4-oxadiazol-2-yl]-1-bicyclo[1.1.0]butanyl]pyrazolo[1,5-a]pyridine-2-carboxamide has a molecular weight of 453.81 g/mol, XLogP of 3.37, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 6-chloro-N-[3-[5-[3-(trifluoromethoxy)cyclobutyl]-1,3,4-oxadiazol-2-yl]-1-bicyclo[1.1.0]butanyl]pyrazolo[1,5-a]pyridine-2-carboxamide is sourced from PubChem (CID 142528143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).