5-fluoro-N-methyl-1H-indazole-3-carboxamide

C9H8FN3O — CID 110469324

IUPAC5-fluoro-N-methyl-1H-indazole-3-carboxamide
SMILESCNC(=O)c1n[nH]c2ccc(F)cc12
InChIInChI=1S/C9H8FN3O/c1-11-9(14)8-6-4-5(10)2-3-7(6)12-13-8/h2-4H,1H3,(H,11,14)(H,12,13)
InChIKeyYXGICJQWMOYODP-UHFFFAOYSA-N
MW193.18 g/mol
LogP1.06
Rot. Bonds1

About 5-fluoro-N-methyl-1H-indazole-3-carboxamide

5-fluoro-N-methyl-1H-indazole-3-carboxamide (PubChem CID 110469324) has the molecular formula C9H8FN3O and a molecular weight of 193.18 g/mol. Its IUPAC name is 5-fluoro-N-methyl-1H-indazole-3-carboxamide.

Molecular Properties

Compound Name5-fluoro-N-methyl-1H-indazole-3-carboxamide
PubChem CID110469324
Molecular FormulaC9H8FN3O
Molecular Weight193.18 g/mol
Exact Mass193.07
IUPAC Name5-fluoro-N-methyl-1H-indazole-3-carboxamide
SMILESCNC(=O)c1n[nH]c2ccc(F)cc12
InChIInChI=1S/C9H8FN3O/c1-11-9(14)8-6-4-5(10)2-3-7(6)12-13-8/h2-4H,1H3,(H,11,14)(H,12,13)
InChIKeyYXGICJQWMOYODP-UHFFFAOYSA-N
XLogP1.06
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.18
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-methyl-1H-indazole-3-carboxamide?
The IUPAC name of 5-fluoro-N-methyl-1H-indazole-3-carboxamide (CID 110469324) is 5-fluoro-N-methyl-1H-indazole-3-carboxamide.
What is the SMILES notation for 5-fluoro-N-methyl-1H-indazole-3-carboxamide?
The canonical SMILES for 5-fluoro-N-methyl-1H-indazole-3-carboxamide is CNC(=O)c1n[nH]c2ccc(F)cc12.
What is the InChIKey of 5-fluoro-N-methyl-1H-indazole-3-carboxamide?
The InChIKey is YXGICJQWMOYODP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8FN3O/c1-11-9(14)8-6-4-5(10)2-3-7(6)12-13-8/h2-4H,1H3,(H,11,14)(H,12,13).
What are the key properties of 5-fluoro-N-methyl-1H-indazole-3-carboxamide?
5-fluoro-N-methyl-1H-indazole-3-carboxamide has a molecular weight of 193.18 g/mol, XLogP of 1.06, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-methyl-1H-indazole-3-carboxamide is sourced from PubChem (CID 110469324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).