N-(2-fluorophenyl)-4-(pyrazolo[1,5-a]pyridin-2-ylmethyl)piperazine-1-carboxamide

C19H20FN5O — CID 90571599

IUPACN-(2-fluorophenyl)-4-(pyrazolo[1,5-a]pyridin-2-ylmethyl)piperazine-1-carboxamide
SMILESO=C(Nc1ccccc1F)N1CCN(Cc2cc3ccccn3n2)CC1
InChIInChI=1S/C19H20FN5O/c20-17-6-1-2-7-18(17)21-19(26)24-11-9-23(10-12-24)14-15-13-16-5-3-4-8-25(16)22-15/h1-8,13H,9-12,14H2,(H,21,26)
InChIKeyWGIFSCUKMGCLQJ-UHFFFAOYSA-N
MW353.40 g/mol
LogP2.82
Rot. Bonds3

About N-(2-fluorophenyl)-4-(pyrazolo[1,5-a]pyridin-2-ylmethyl)piperazine-1-carboxamide

N-(2-fluorophenyl)-4-(pyrazolo[1,5-a]pyridin-2-ylmethyl)piperazine-1-carboxamide (PubChem CID 90571599) has the molecular formula C19H20FN5O and a molecular weight of 353.40 g/mol. Its IUPAC name is N-(2-fluorophenyl)-4-(pyrazolo[1,5-a]pyridin-2-ylmethyl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-4-(pyrazolo[1,5-a]pyridin-2-ylmethyl)piperazine-1-carboxamide
PubChem CID90571599
Molecular FormulaC19H20FN5O
Molecular Weight353.40 g/mol
Exact Mass353.17
IUPAC NameN-(2-fluorophenyl)-4-(pyrazolo[1,5-a]pyridin-2-ylmethyl)piperazine-1-carboxamide
SMILESO=C(Nc1ccccc1F)N1CCN(Cc2cc3ccccn3n2)CC1
InChIInChI=1S/C19H20FN5O/c20-17-6-1-2-7-18(17)21-19(26)24-11-9-23(10-12-24)14-15-13-16-5-3-4-8-25(16)22-15/h1-8,13H,9-12,14H2,(H,21,26)
InChIKeyWGIFSCUKMGCLQJ-UHFFFAOYSA-N
XLogP2.82
TPSA52.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.40
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-4-(pyrazolo[1,5-a]pyridin-2-ylmethyl)piperazine-1-carboxamide?
The IUPAC name of N-(2-fluorophenyl)-4-(pyrazolo[1,5-a]pyridin-2-ylmethyl)piperazine-1-carboxamide (CID 90571599) is N-(2-fluorophenyl)-4-(pyrazolo[1,5-a]pyridin-2-ylmethyl)piperazine-1-carboxamide.
What is the SMILES notation for N-(2-fluorophenyl)-4-(pyrazolo[1,5-a]pyridin-2-ylmethyl)piperazine-1-carboxamide?
The canonical SMILES for N-(2-fluorophenyl)-4-(pyrazolo[1,5-a]pyridin-2-ylmethyl)piperazine-1-carboxamide is O=C(Nc1ccccc1F)N1CCN(Cc2cc3ccccn3n2)CC1.
What is the InChIKey of N-(2-fluorophenyl)-4-(pyrazolo[1,5-a]pyridin-2-ylmethyl)piperazine-1-carboxamide?
The InChIKey is WGIFSCUKMGCLQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FN5O/c20-17-6-1-2-7-18(17)21-19(26)24-11-9-23(10-12-24)14-15-13-16-5-3-4-8-25(16)22-15/h1-8,13H,9-12,14H2,(H,21,26).
What are the key properties of N-(2-fluorophenyl)-4-(pyrazolo[1,5-a]pyridin-2-ylmethyl)piperazine-1-carboxamide?
N-(2-fluorophenyl)-4-(pyrazolo[1,5-a]pyridin-2-ylmethyl)piperazine-1-carboxamide has a molecular weight of 353.40 g/mol, XLogP of 2.82, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-4-(pyrazolo[1,5-a]pyridin-2-ylmethyl)piperazine-1-carboxamide is sourced from PubChem (CID 90571599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).