Cis-(1S,2S)-N-[5-[5-(difluoromethyl)-1H-indazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide

C₁₉H₁₄F₃N₅O — CID 164718324

About Cis-(1S,2S)-N-[5-[5-(difluoromethyl)-1H-indazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide

Cis-(1S,2S)-N-[5-[5-(difluoromethyl)-1H-indazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide (PubChem CID 164718324) has the molecular formula C₁₉H₁₄F₃N₅O and a molecular weight of 385.35 g/mol. Its IUPAC name is cis-(1S,2S)-N-[5-[5-(difluoromethyl)-1H-indazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide.

Molecular Properties

• Compound Name: Cis-(1S,2S)-N-[5-[5-(difluoromethyl)-1H-indazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide
• PubChem CID: 164718324
• Molecular Formula: C₁₉H₁₄F₃N₅O
• Molecular Weight: 385.35 g/mol
• Exact Mass: 385.12
• IUPAC Name: cis-(1S,2S)-N-[5-[5-(difluoromethyl)-1H-indazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide
• SMILES: O=C(Nc1cc2cc(-c3c(C(F)F)ccc4[nH]ncc34)ccn2n1)[C@@H]1C[C@@H]1F
• InChI: InChI=1S/C19H14F3N5O/c20-14-7-12(14)19(28)24-16-6-10-5-9(3-4-27(10)26-16)17-11(18(21)22)1-2-15-13(17)8-23-25-15/h1-6,8,12,14,18H,7H2,(H,23,25)(H,24,26,28)/t12-,14+/m1/s1
• InChIKey: VJJLFEXXGMMCGO-OCCSQVGLSA-N
• XLogP: 4.11
• TPSA: 75.08 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 4
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	385.35
LogP ≤ 5	4.11
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of Cis-(1S,2S)-N-[5-[5-(difluoromethyl)-1H-indazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide?

The IUPAC name of Cis-(1S,2S)-N-[5-[5-(difluoromethyl)-1H-indazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide (CID 164718324) is cis-(1S,2S)-N-[5-[5-(difluoromethyl)-1H-indazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide.

What is the SMILES notation for Cis-(1S,2S)-N-[5-[5-(difluoromethyl)-1H-indazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide?

The canonical SMILES for Cis-(1S,2S)-N-[5-[5-(difluoromethyl)-1H-indazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide is O=C(Nc1cc2cc(-c3c(C(F)F)ccc4[nH]ncc34)ccn2n1)[C@@H]1C[C@@H]1F.

What is the InChIKey of Cis-(1S,2S)-N-[5-[5-(difluoromethyl)-1H-indazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide?

The InChIKey is VJJLFEXXGMMCGO-OCCSQVGLSA-N. The full InChI is InChI=1S/C19H14F3N5O/c20-14-7-12(14)19(28)24-16-6-10-5-9(3-4-27(10)26-16)17-11(18(21)22)1-2-15-13(17)8-23-25-15/h1-6,8,12,14,18H,7H2,(H,23,25)(H,24,26,28)/t12-,14+/m1/s1.

What are the key properties of Cis-(1S,2S)-N-[5-[5-(difluoromethyl)-1H-indazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide?

Cis-(1S,2S)-N-[5-[5-(difluoromethyl)-1H-indazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide has a molecular weight of 385.35 g/mol, XLogP of 4.11, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for Cis-(1S,2S)-N-[5-[5-(difluoromethyl)-1H-indazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide is sourced from PubChem (CID 164718324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 164718324 — identifiers, structure, computed properties (public domain)

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