5-chloro-N-(2-fluorophenyl)indazole-1-carboxamide

C14H9ClFN3O — CID 22510699

IUPAC5-chloro-N-(2-fluorophenyl)indazole-1-carboxamide
SMILESO=C(Nc1ccccc1F)n1ncc2cc(Cl)ccc21
InChIInChI=1S/C14H9ClFN3O/c15-10-5-6-13-9(7-10)8-17-19(13)14(20)18-12-4-2-1-3-11(12)16/h1-8H,(H,18,20)
InChIKeyHUSHSSSDZQATDB-UHFFFAOYSA-N
MW289.70 g/mol
LogP3.91
Rot. Bonds1

About 5-chloro-N-(2-fluorophenyl)indazole-1-carboxamide

5-chloro-N-(2-fluorophenyl)indazole-1-carboxamide (PubChem CID 22510699) has the molecular formula C14H9ClFN3O and a molecular weight of 289.70 g/mol. Its IUPAC name is 5-chloro-N-(2-fluorophenyl)indazole-1-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(2-fluorophenyl)indazole-1-carboxamide
PubChem CID22510699
Molecular FormulaC14H9ClFN3O
Molecular Weight289.70 g/mol
Exact Mass289.04
IUPAC Name5-chloro-N-(2-fluorophenyl)indazole-1-carboxamide
SMILESO=C(Nc1ccccc1F)n1ncc2cc(Cl)ccc21
InChIInChI=1S/C14H9ClFN3O/c15-10-5-6-13-9(7-10)8-17-19(13)14(20)18-12-4-2-1-3-11(12)16/h1-8H,(H,18,20)
InChIKeyHUSHSSSDZQATDB-UHFFFAOYSA-N
XLogP3.91
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.70
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2-fluorophenyl)indazole-1-carboxamide?
The IUPAC name of 5-chloro-N-(2-fluorophenyl)indazole-1-carboxamide (CID 22510699) is 5-chloro-N-(2-fluorophenyl)indazole-1-carboxamide.
What is the SMILES notation for 5-chloro-N-(2-fluorophenyl)indazole-1-carboxamide?
The canonical SMILES for 5-chloro-N-(2-fluorophenyl)indazole-1-carboxamide is O=C(Nc1ccccc1F)n1ncc2cc(Cl)ccc21.
What is the InChIKey of 5-chloro-N-(2-fluorophenyl)indazole-1-carboxamide?
The InChIKey is HUSHSSSDZQATDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClFN3O/c15-10-5-6-13-9(7-10)8-17-19(13)14(20)18-12-4-2-1-3-11(12)16/h1-8H,(H,18,20).
What are the key properties of 5-chloro-N-(2-fluorophenyl)indazole-1-carboxamide?
5-chloro-N-(2-fluorophenyl)indazole-1-carboxamide has a molecular weight of 289.70 g/mol, XLogP of 3.91, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-fluorophenyl)indazole-1-carboxamide is sourced from PubChem (CID 22510699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).