N-[3-(4-fluorophenyl)-1H-indazol-5-yl]pyridine-4-carboxamide

C19H13FN4O — CID 22479938

IUPACN-[3-(4-fluorophenyl)-1H-indazol-5-yl]pyridine-4-carboxamide
SMILESO=C(Nc1ccc2[nH]nc(-c3ccc(F)cc3)c2c1)c1ccncc1
InChIInChI=1S/C19H13FN4O/c20-14-3-1-12(2-4-14)18-16-11-15(5-6-17(16)23-24-18)22-19(25)13-7-9-21-10-8-13/h1-11H,(H,22,25)(H,23,24)
InChIKeyPMAXGPDOUUTNPG-UHFFFAOYSA-N
MW332.34 g/mol
LogP4.02
Rot. Bonds3

About N-[3-(4-fluorophenyl)-1H-indazol-5-yl]pyridine-4-carboxamide

N-[3-(4-fluorophenyl)-1H-indazol-5-yl]pyridine-4-carboxamide (PubChem CID 22479938) has the molecular formula C19H13FN4O and a molecular weight of 332.34 g/mol. Its IUPAC name is N-[3-(4-fluorophenyl)-1H-indazol-5-yl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[3-(4-fluorophenyl)-1H-indazol-5-yl]pyridine-4-carboxamide
PubChem CID22479938
Molecular FormulaC19H13FN4O
Molecular Weight332.34 g/mol
Exact Mass332.11
IUPAC NameN-[3-(4-fluorophenyl)-1H-indazol-5-yl]pyridine-4-carboxamide
SMILESO=C(Nc1ccc2[nH]nc(-c3ccc(F)cc3)c2c1)c1ccncc1
InChIInChI=1S/C19H13FN4O/c20-14-3-1-12(2-4-14)18-16-11-15(5-6-17(16)23-24-18)22-19(25)13-7-9-21-10-8-13/h1-11H,(H,22,25)(H,23,24)
InChIKeyPMAXGPDOUUTNPG-UHFFFAOYSA-N
XLogP4.02
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.34
LogP ≤ 54.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[3-(4-fluorophenyl)-1H-indazol-5-yl]pyridine-4-carboxamide?
The IUPAC name of N-[3-(4-fluorophenyl)-1H-indazol-5-yl]pyridine-4-carboxamide (CID 22479938) is N-[3-(4-fluorophenyl)-1H-indazol-5-yl]pyridine-4-carboxamide.
What is the SMILES notation for N-[3-(4-fluorophenyl)-1H-indazol-5-yl]pyridine-4-carboxamide?
The canonical SMILES for N-[3-(4-fluorophenyl)-1H-indazol-5-yl]pyridine-4-carboxamide is O=C(Nc1ccc2[nH]nc(-c3ccc(F)cc3)c2c1)c1ccncc1.
What is the InChIKey of N-[3-(4-fluorophenyl)-1H-indazol-5-yl]pyridine-4-carboxamide?
The InChIKey is PMAXGPDOUUTNPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13FN4O/c20-14-3-1-12(2-4-14)18-16-11-15(5-6-17(16)23-24-18)22-19(25)13-7-9-21-10-8-13/h1-11H,(H,22,25)(H,23,24).
What are the key properties of N-[3-(4-fluorophenyl)-1H-indazol-5-yl]pyridine-4-carboxamide?
N-[3-(4-fluorophenyl)-1H-indazol-5-yl]pyridine-4-carboxamide has a molecular weight of 332.34 g/mol, XLogP of 4.02, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-fluorophenyl)-1H-indazol-5-yl]pyridine-4-carboxamide is sourced from PubChem (CID 22479938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).