cis-(1S,2S)-N-[5-(5-ethoxy-6-fluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide

C20H17F2N5O2 — CID 163221050

IUPACcis-(1S,2S)-N-[5-(5-ethoxy-6-fluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide
SMILESCCOc1c(F)cc2[nH]ncc2c1-c1ccn2nc(NC(=O)[C@@H]3C[C@@H]3F)cc2c1
InChIInChI=1S/C20H17F2N5O2/c1-2-29-19-15(22)8-16-13(9-23-25-16)18(19)10-3-4-27-11(5-10)6-17(26-27)24-20(28)12-7-14(12)21/h3-6,8-9,12,14H,2,7H2,1H3,(H,23,25)(H,24,26,28)/t12-,14+/m1/s1
InChIKeySTZHETBFNWMKAF-OCCSQVGLSA-N
MW397.39 g/mol
LogP3.71
Rot. Bonds5

About cis-(1S,2S)-N-[5-(5-ethoxy-6-fluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide

cis-(1S,2S)-N-[5-(5-ethoxy-6-fluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide (PubChem CID 163221050) has the molecular formula C20H17F2N5O2 and a molecular weight of 397.39 g/mol. Its IUPAC name is cis-(1S,2S)-N-[5-(5-ethoxy-6-fluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide.

Molecular Properties

Compound Namecis-(1S,2S)-N-[5-(5-ethoxy-6-fluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide
PubChem CID163221050
Molecular FormulaC20H17F2N5O2
Molecular Weight397.39 g/mol
Exact Mass397.14
IUPAC Namecis-(1S,2S)-N-[5-(5-ethoxy-6-fluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide
SMILESCCOc1c(F)cc2[nH]ncc2c1-c1ccn2nc(NC(=O)[C@@H]3C[C@@H]3F)cc2c1
InChIInChI=1S/C20H17F2N5O2/c1-2-29-19-15(22)8-16-13(9-23-25-16)18(19)10-3-4-27-11(5-10)6-17(26-27)24-20(28)12-7-14(12)21/h3-6,8-9,12,14H,2,7H2,1H3,(H,23,25)(H,24,26,28)/t12-,14+/m1/s1
InChIKeySTZHETBFNWMKAF-OCCSQVGLSA-N
XLogP3.71
TPSA84.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.39
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze cis-(1S,2S)-N-[5-(5-ethoxy-6-fluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide with MolForge

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Related Compounds

6-(3-fluoro-2-methyl-4-pyridinyl)-5-methoxy-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine
CID 166635576
5-[6-(methylaminomethyl)pyrimidin-4-yl]oxy-N-[5-[1-(trifluoromethyl)cyclopropyl]-1H-pyrazol-3-yl]indole-1-carboxamide
CID 59394395
3-[2-[(3R,4R)-3,4-difluoropyrrolidin-1-yl]-4-pyridinyl]-5-propan-2-yloxy-1H-indazole
CID 137658381
US11649255, Example 506
CID 163221127
US11649255, Example 509
CID 163221168
US11649255, Example 493
CID 163221205
US11649255, Example 650
CID 164520267
US11649255, Example 492
CID 164520296
US11649255, Example 543
CID 164520315
US11649255, Example 534
CID 164520346
US11649255, Example 467
CID 164520385
US11649255, Example 531
CID 164520406

Frequently Asked Questions

What is the IUPAC name of cis-(1S,2S)-N-[5-(5-ethoxy-6-fluoro-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-ethoxy-6-fluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide (CID 163221050) is cis-(1S,2S)-N-[5-(5-ethoxy-6-fluoro-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-ethoxy-6-fluoro-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-ethoxy-6-fluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide is CCOc1c(F)cc2[nH]ncc2c1-c1ccn2nc(NC(=O)[C@@H]3C[C@@H]3F)cc2c1.
What is the InChIKey of cis-(1S,2S)-N-[5-(5-ethoxy-6-fluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide?
The InChIKey is STZHETBFNWMKAF-OCCSQVGLSA-N. The full InChI is InChI=1S/C20H17F2N5O2/c1-2-29-19-15(22)8-16-13(9-23-25-16)18(19)10-3-4-27-11(5-10)6-17(26-27)24-20(28)12-7-14(12)21/h3-6,8-9,12,14H,2,7H2,1H3,(H,23,25)(H,24,26,28)/t12-,14+/m1/s1.
What are the key properties of cis-(1S,2S)-N-[5-(5-ethoxy-6-fluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide?
cis-(1S,2S)-N-[5-(5-ethoxy-6-fluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide has a molecular weight of 397.39 g/mol, XLogP of 3.71, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1S,2S)-N-[5-(5-ethoxy-6-fluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide is sourced from PubChem (CID 163221050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).