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

C23H16FN5O2 — CID 54589156

IUPAC1-(4-fluorophenyl)-N-(5-methyl-3-phenyl-1,2-oxazol-4-yl)pyrazolo[5,4-c]pyridine-4-carboxamide
SMILESCc1onc(-c2ccccc2)c1NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1
InChIInChI=1S/C23H16FN5O2/c1-14-21(22(28-31-14)15-5-3-2-4-6-15)27-23(30)19-11-25-13-20-18(19)12-26-29(20)17-9-7-16(24)8-10-17/h2-13H,1H3,(H,27,30)
InChIKeyZIBPFHMKGOCAIX-UHFFFAOYSA-N
MW413.41 g/mol
LogP4.78
Rot. Bonds4

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

1-(4-fluorophenyl)-N-(5-methyl-3-phenyl-1,2-oxazol-4-yl)pyrazolo[5,4-c]pyridine-4-carboxamide (PubChem CID 54589156) has the molecular formula C23H16FN5O2 and a molecular weight of 413.41 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-(5-methyl-3-phenyl-1,2-oxazol-4-yl)pyrazolo[5,4-c]pyridine-4-carboxamide.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-(5-methyl-3-phenyl-1,2-oxazol-4-yl)pyrazolo[5,4-c]pyridine-4-carboxamide
PubChem CID54589156
Molecular FormulaC23H16FN5O2
Molecular Weight413.41 g/mol
Exact Mass413.13
IUPAC Name1-(4-fluorophenyl)-N-(5-methyl-3-phenyl-1,2-oxazol-4-yl)pyrazolo[5,4-c]pyridine-4-carboxamide
SMILESCc1onc(-c2ccccc2)c1NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1
InChIInChI=1S/C23H16FN5O2/c1-14-21(22(28-31-14)15-5-3-2-4-6-15)27-23(30)19-11-25-13-20-18(19)12-26-29(20)17-9-7-16(24)8-10-17/h2-13H,1H3,(H,27,30)
InChIKeyZIBPFHMKGOCAIX-UHFFFAOYSA-N
XLogP4.78
TPSA85.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.41
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-(5-methyl-3-phenyl-1,2-oxazol-4-yl)pyrazolo[5,4-c]pyridine-4-carboxamide?
The IUPAC name of 1-(4-fluorophenyl)-N-(5-methyl-3-phenyl-1,2-oxazol-4-yl)pyrazolo[5,4-c]pyridine-4-carboxamide (CID 54589156) is 1-(4-fluorophenyl)-N-(5-methyl-3-phenyl-1,2-oxazol-4-yl)pyrazolo[5,4-c]pyridine-4-carboxamide.
What is the SMILES notation for 1-(4-fluorophenyl)-N-(5-methyl-3-phenyl-1,2-oxazol-4-yl)pyrazolo[5,4-c]pyridine-4-carboxamide?
The canonical SMILES for 1-(4-fluorophenyl)-N-(5-methyl-3-phenyl-1,2-oxazol-4-yl)pyrazolo[5,4-c]pyridine-4-carboxamide is Cc1onc(-c2ccccc2)c1NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-N-(5-methyl-3-phenyl-1,2-oxazol-4-yl)pyrazolo[5,4-c]pyridine-4-carboxamide?
The InChIKey is ZIBPFHMKGOCAIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16FN5O2/c1-14-21(22(28-31-14)15-5-3-2-4-6-15)27-23(30)19-11-25-13-20-18(19)12-26-29(20)17-9-7-16(24)8-10-17/h2-13H,1H3,(H,27,30).
What are the key properties of 1-(4-fluorophenyl)-N-(5-methyl-3-phenyl-1,2-oxazol-4-yl)pyrazolo[5,4-c]pyridine-4-carboxamide?
1-(4-fluorophenyl)-N-(5-methyl-3-phenyl-1,2-oxazol-4-yl)pyrazolo[5,4-c]pyridine-4-carboxamide has a molecular weight of 413.41 g/mol, XLogP of 4.78, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-N-(5-methyl-3-phenyl-1,2-oxazol-4-yl)pyrazolo[5,4-c]pyridine-4-carboxamide is sourced from PubChem (CID 54589156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).