3-fluoro-N-(1H-indazol-5-yl)benzamide

C14H10FN3O — CID 6466450

IUPAC3-fluoro-N-(1H-indazol-5-yl)benzamide
SMILESO=C(Nc1ccc2[nH]ncc2c1)c1cccc(F)c1
InChIInChI=1S/C14H10FN3O/c15-11-3-1-2-9(6-11)14(19)17-12-4-5-13-10(7-12)8-16-18-13/h1-8H,(H,16,18)(H,17,19)
InChIKeyRAUYTJLQISREEJ-UHFFFAOYSA-N
MW255.25 g/mol
LogP2.95
Rot. Bonds2

About 3-fluoro-N-(1H-indazol-5-yl)benzamide

3-fluoro-N-(1H-indazol-5-yl)benzamide (PubChem CID 6466450) has the molecular formula C14H10FN3O and a molecular weight of 255.25 g/mol. Its IUPAC name is 3-fluoro-N-(1H-indazol-5-yl)benzamide.

Molecular Properties

Compound Name3-fluoro-N-(1H-indazol-5-yl)benzamide
PubChem CID6466450
Molecular FormulaC14H10FN3O
Molecular Weight255.25 g/mol
Exact Mass255.08
IUPAC Name3-fluoro-N-(1H-indazol-5-yl)benzamide
SMILESO=C(Nc1ccc2[nH]ncc2c1)c1cccc(F)c1
InChIInChI=1S/C14H10FN3O/c15-11-3-1-2-9(6-11)14(19)17-12-4-5-13-10(7-12)8-16-18-13/h1-8H,(H,16,18)(H,17,19)
InChIKeyRAUYTJLQISREEJ-UHFFFAOYSA-N
XLogP2.95
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.25
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-(1H-indazol-5-yl)benzamide?
The IUPAC name of 3-fluoro-N-(1H-indazol-5-yl)benzamide (CID 6466450) is 3-fluoro-N-(1H-indazol-5-yl)benzamide.
What is the SMILES notation for 3-fluoro-N-(1H-indazol-5-yl)benzamide?
The canonical SMILES for 3-fluoro-N-(1H-indazol-5-yl)benzamide is O=C(Nc1ccc2[nH]ncc2c1)c1cccc(F)c1.
What is the InChIKey of 3-fluoro-N-(1H-indazol-5-yl)benzamide?
The InChIKey is RAUYTJLQISREEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10FN3O/c15-11-3-1-2-9(6-11)14(19)17-12-4-5-13-10(7-12)8-16-18-13/h1-8H,(H,16,18)(H,17,19).
What are the key properties of 3-fluoro-N-(1H-indazol-5-yl)benzamide?
3-fluoro-N-(1H-indazol-5-yl)benzamide has a molecular weight of 255.25 g/mol, XLogP of 2.95, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-(1H-indazol-5-yl)benzamide is sourced from PubChem (CID 6466450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).