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

C20H16FN5O2 — CID 164718165

IUPACcis-(1S,2S)-N-[5-(5-acetyl-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide
SMILESCC(=O)c1ccc2[nH]ncc2c1-c1ccn2nc(NC(=O)[C@@H]3C[C@@H]3F)cc2c1
InChIInChI=1S/C20H16FN5O2/c1-10(27)13-2-3-17-15(9-22-24-17)19(13)11-4-5-26-12(6-11)7-18(25-26)23-20(28)14-8-16(14)21/h2-7,9,14,16H,8H2,1H3,(H,22,24)(H,23,25,28)/t14-,16+/m1/s1
InChIKeyYZPKOECVZOFRTF-ZBFHGGJFSA-N
MW377.38 g/mol
LogP3.38
Rot. Bonds4

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

cis-(1S,2S)-N-[5-(5-acetyl-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide (PubChem CID 164718165) has the molecular formula C20H16FN5O2 and a molecular weight of 377.38 g/mol. Its IUPAC name is cis-(1S,2S)-N-[5-(5-acetyl-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide.

Molecular Properties

Compound Namecis-(1S,2S)-N-[5-(5-acetyl-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide
PubChem CID164718165
Molecular FormulaC20H16FN5O2
Molecular Weight377.38 g/mol
Exact Mass377.13
IUPAC Namecis-(1S,2S)-N-[5-(5-acetyl-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide
SMILESCC(=O)c1ccc2[nH]ncc2c1-c1ccn2nc(NC(=O)[C@@H]3C[C@@H]3F)cc2c1
InChIInChI=1S/C20H16FN5O2/c1-10(27)13-2-3-17-15(9-22-24-17)19(13)11-4-5-26-12(6-11)7-18(25-26)23-20(28)14-8-16(14)21/h2-7,9,14,16H,8H2,1H3,(H,22,24)(H,23,25,28)/t14-,16+/m1/s1
InChIKeyYZPKOECVZOFRTF-ZBFHGGJFSA-N
XLogP3.38
TPSA92.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.38
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of cis-(1S,2S)-N-[5-(5-acetyl-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-acetyl-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide (CID 164718165) is cis-(1S,2S)-N-[5-(5-acetyl-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-acetyl-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-acetyl-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide is CC(=O)c1ccc2[nH]ncc2c1-c1ccn2nc(NC(=O)[C@@H]3C[C@@H]3F)cc2c1.
What is the InChIKey of cis-(1S,2S)-N-[5-(5-acetyl-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide?
The InChIKey is YZPKOECVZOFRTF-ZBFHGGJFSA-N. The full InChI is InChI=1S/C20H16FN5O2/c1-10(27)13-2-3-17-15(9-22-24-17)19(13)11-4-5-26-12(6-11)7-18(25-26)23-20(28)14-8-16(14)21/h2-7,9,14,16H,8H2,1H3,(H,22,24)(H,23,25,28)/t14-,16+/m1/s1.
What are the key properties of cis-(1S,2S)-N-[5-(5-acetyl-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide?
cis-(1S,2S)-N-[5-(5-acetyl-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide has a molecular weight of 377.38 g/mol, XLogP of 3.38, 4 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-acetyl-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide is sourced from PubChem (CID 164718165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).