1-(4-fluorophenyl)-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pyrazolo[5,4-c]pyridine-4-carboxamide

C22H15FN6O2 — CID 54589114

IUPAC1-(4-fluorophenyl)-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pyrazolo[5,4-c]pyridine-4-carboxamide
SMILESCc1cc(-c2nnco2)ccc1NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1
InChIInChI=1S/C22H15FN6O2/c1-13-8-14(22-28-25-12-31-22)2-7-19(13)27-21(30)18-9-24-11-20-17(18)10-26-29(20)16-5-3-15(23)4-6-16/h2-12H,1H3,(H,27,30)
InChIKeyYYFWLDRDDHGEDD-UHFFFAOYSA-N
MW414.40 g/mol
LogP4.17
Rot. Bonds4

About 1-(4-fluorophenyl)-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pyrazolo[5,4-c]pyridine-4-carboxamide

1-(4-fluorophenyl)-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pyrazolo[5,4-c]pyridine-4-carboxamide (PubChem CID 54589114) has the molecular formula C22H15FN6O2 and a molecular weight of 414.40 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pyrazolo[5,4-c]pyridine-4-carboxamide.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pyrazolo[5,4-c]pyridine-4-carboxamide
PubChem CID54589114
Molecular FormulaC22H15FN6O2
Molecular Weight414.40 g/mol
Exact Mass414.12
IUPAC Name1-(4-fluorophenyl)-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pyrazolo[5,4-c]pyridine-4-carboxamide
SMILESCc1cc(-c2nnco2)ccc1NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1
InChIInChI=1S/C22H15FN6O2/c1-13-8-14(22-28-25-12-31-22)2-7-19(13)27-21(30)18-9-24-11-20-17(18)10-26-29(20)16-5-3-15(23)4-6-16/h2-12H,1H3,(H,27,30)
InChIKeyYYFWLDRDDHGEDD-UHFFFAOYSA-N
XLogP4.17
TPSA98.73 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.40
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pyrazolo[5,4-c]pyridine-4-carboxamide?
The IUPAC name of 1-(4-fluorophenyl)-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pyrazolo[5,4-c]pyridine-4-carboxamide (CID 54589114) is 1-(4-fluorophenyl)-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pyrazolo[5,4-c]pyridine-4-carboxamide.
What is the SMILES notation for 1-(4-fluorophenyl)-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pyrazolo[5,4-c]pyridine-4-carboxamide?
The canonical SMILES for 1-(4-fluorophenyl)-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pyrazolo[5,4-c]pyridine-4-carboxamide is Cc1cc(-c2nnco2)ccc1NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pyrazolo[5,4-c]pyridine-4-carboxamide?
The InChIKey is YYFWLDRDDHGEDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15FN6O2/c1-13-8-14(22-28-25-12-31-22)2-7-19(13)27-21(30)18-9-24-11-20-17(18)10-26-29(20)16-5-3-15(23)4-6-16/h2-12H,1H3,(H,27,30).
What are the key properties of 1-(4-fluorophenyl)-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pyrazolo[5,4-c]pyridine-4-carboxamide?
1-(4-fluorophenyl)-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pyrazolo[5,4-c]pyridine-4-carboxamide has a molecular weight of 414.40 g/mol, XLogP of 4.17, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pyrazolo[5,4-c]pyridine-4-carboxamide is sourced from PubChem (CID 54589114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).