1-(4-fluorophenyl)-N-(4-methylpentan-2-yl)pyrazolo[5,4-b]pyridine-3-carboxamide

C19H21FN4O — CID 46093262

IUPAC1-(4-fluorophenyl)-N-(4-methylpentan-2-yl)pyrazolo[5,4-b]pyridine-3-carboxamide
SMILESCC(C)CC(C)NC(=O)c1nn(-c2ccc(F)cc2)c2ncccc12
InChIInChI=1S/C19H21FN4O/c1-12(2)11-13(3)22-19(25)17-16-5-4-10-21-18(16)24(23-17)15-8-6-14(20)7-9-15/h4-10,12-13H,11H2,1-3H3,(H,22,25)
InChIKeyOYPNUXVHLXDHDF-UHFFFAOYSA-N
MW340.40 g/mol
LogP3.72
Rot. Bonds5

About 1-(4-fluorophenyl)-N-(4-methylpentan-2-yl)pyrazolo[5,4-b]pyridine-3-carboxamide

1-(4-fluorophenyl)-N-(4-methylpentan-2-yl)pyrazolo[5,4-b]pyridine-3-carboxamide (PubChem CID 46093262) has the molecular formula C19H21FN4O and a molecular weight of 340.40 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-(4-methylpentan-2-yl)pyrazolo[5,4-b]pyridine-3-carboxamide.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-(4-methylpentan-2-yl)pyrazolo[5,4-b]pyridine-3-carboxamide
PubChem CID46093262
Molecular FormulaC19H21FN4O
Molecular Weight340.40 g/mol
Exact Mass340.17
IUPAC Name1-(4-fluorophenyl)-N-(4-methylpentan-2-yl)pyrazolo[5,4-b]pyridine-3-carboxamide
SMILESCC(C)CC(C)NC(=O)c1nn(-c2ccc(F)cc2)c2ncccc12
InChIInChI=1S/C19H21FN4O/c1-12(2)11-13(3)22-19(25)17-16-5-4-10-21-18(16)24(23-17)15-8-6-14(20)7-9-15/h4-10,12-13H,11H2,1-3H3,(H,22,25)
InChIKeyOYPNUXVHLXDHDF-UHFFFAOYSA-N
XLogP3.72
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.40
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-(4-methylpentan-2-yl)pyrazolo[5,4-b]pyridine-3-carboxamide?
The IUPAC name of 1-(4-fluorophenyl)-N-(4-methylpentan-2-yl)pyrazolo[5,4-b]pyridine-3-carboxamide (CID 46093262) is 1-(4-fluorophenyl)-N-(4-methylpentan-2-yl)pyrazolo[5,4-b]pyridine-3-carboxamide.
What is the SMILES notation for 1-(4-fluorophenyl)-N-(4-methylpentan-2-yl)pyrazolo[5,4-b]pyridine-3-carboxamide?
The canonical SMILES for 1-(4-fluorophenyl)-N-(4-methylpentan-2-yl)pyrazolo[5,4-b]pyridine-3-carboxamide is CC(C)CC(C)NC(=O)c1nn(-c2ccc(F)cc2)c2ncccc12.
What is the InChIKey of 1-(4-fluorophenyl)-N-(4-methylpentan-2-yl)pyrazolo[5,4-b]pyridine-3-carboxamide?
The InChIKey is OYPNUXVHLXDHDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN4O/c1-12(2)11-13(3)22-19(25)17-16-5-4-10-21-18(16)24(23-17)15-8-6-14(20)7-9-15/h4-10,12-13H,11H2,1-3H3,(H,22,25).
What are the key properties of 1-(4-fluorophenyl)-N-(4-methylpentan-2-yl)pyrazolo[5,4-b]pyridine-3-carboxamide?
1-(4-fluorophenyl)-N-(4-methylpentan-2-yl)pyrazolo[5,4-b]pyridine-3-carboxamide has a molecular weight of 340.40 g/mol, XLogP of 3.72, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-N-(4-methylpentan-2-yl)pyrazolo[5,4-b]pyridine-3-carboxamide is sourced from PubChem (CID 46093262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).