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

C20H18FN5O — CID 164718368

IUPACcis-(1S,2S)-N-[5-(5-ethyl-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide
SMILESCCc1ccc2[nH]ncc2c1-c1ccn2nc(NC(=O)[C@@H]3C[C@@H]3F)cc2c1
InChIInChI=1S/C20H18FN5O/c1-2-11-3-4-17-15(10-22-24-17)19(11)12-5-6-26-13(7-12)8-18(25-26)23-20(27)14-9-16(14)21/h3-8,10,14,16H,2,9H2,1H3,(H,22,24)(H,23,25,27)/t14-,16+/m1/s1
InChIKeyWOUAAUGOXUSQGP-ZBFHGGJFSA-N
MW363.40 g/mol
LogP3.74
Rot. Bonds4

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

cis-(1S,2S)-N-[5-(5-ethyl-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide (PubChem CID 164718368) has the molecular formula C20H18FN5O and a molecular weight of 363.40 g/mol. Its IUPAC name is cis-(1S,2S)-N-[5-(5-ethyl-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide.

Molecular Properties

Compound Namecis-(1S,2S)-N-[5-(5-ethyl-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide
PubChem CID164718368
Molecular FormulaC20H18FN5O
Molecular Weight363.40 g/mol
Exact Mass363.15
IUPAC Namecis-(1S,2S)-N-[5-(5-ethyl-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide
SMILESCCc1ccc2[nH]ncc2c1-c1ccn2nc(NC(=O)[C@@H]3C[C@@H]3F)cc2c1
InChIInChI=1S/C20H18FN5O/c1-2-11-3-4-17-15(10-22-24-17)19(11)12-5-6-26-13(7-12)8-18(25-26)23-20(27)14-9-16(14)21/h3-8,10,14,16H,2,9H2,1H3,(H,22,24)(H,23,25,27)/t14-,16+/m1/s1
InChIKeyWOUAAUGOXUSQGP-ZBFHGGJFSA-N
XLogP3.74
TPSA75.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.40
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of cis-(1S,2S)-N-[5-(5-ethyl-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-ethyl-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide (CID 164718368) is cis-(1S,2S)-N-[5-(5-ethyl-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-ethyl-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-ethyl-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide is CCc1ccc2[nH]ncc2c1-c1ccn2nc(NC(=O)[C@@H]3C[C@@H]3F)cc2c1.
What is the InChIKey of cis-(1S,2S)-N-[5-(5-ethyl-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide?
The InChIKey is WOUAAUGOXUSQGP-ZBFHGGJFSA-N. The full InChI is InChI=1S/C20H18FN5O/c1-2-11-3-4-17-15(10-22-24-17)19(11)12-5-6-26-13(7-12)8-18(25-26)23-20(27)14-9-16(14)21/h3-8,10,14,16H,2,9H2,1H3,(H,22,24)(H,23,25,27)/t14-,16+/m1/s1.
What are the key properties of cis-(1S,2S)-N-[5-(5-ethyl-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide?
cis-(1S,2S)-N-[5-(5-ethyl-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide has a molecular weight of 363.40 g/mol, XLogP of 3.74, 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-ethyl-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide is sourced from PubChem (CID 164718368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).