2-fluoro-N-(3-phenyl-1H-indazol-6-yl)benzamide

C20H14FN3O — CID 117073871

IUPAC2-fluoro-N-(3-phenyl-1H-indazol-6-yl)benzamide
SMILESO=C(Nc1ccc2c(-c3ccccc3)n[nH]c2c1)c1ccccc1F
InChIInChI=1S/C20H14FN3O/c21-17-9-5-4-8-15(17)20(25)22-14-10-11-16-18(12-14)23-24-19(16)13-6-2-1-3-7-13/h1-12H,(H,22,25)(H,23,24)
InChIKeyZRXZOWPQFZVYPF-UHFFFAOYSA-N
MW331.35 g/mol
LogP4.62
Rot. Bonds3

About 2-fluoro-N-(3-phenyl-1H-indazol-6-yl)benzamide

2-fluoro-N-(3-phenyl-1H-indazol-6-yl)benzamide (PubChem CID 117073871) has the molecular formula C20H14FN3O and a molecular weight of 331.35 g/mol. Its IUPAC name is 2-fluoro-N-(3-phenyl-1H-indazol-6-yl)benzamide.

Molecular Properties

Compound Name2-fluoro-N-(3-phenyl-1H-indazol-6-yl)benzamide
PubChem CID117073871
Molecular FormulaC20H14FN3O
Molecular Weight331.35 g/mol
Exact Mass331.11
IUPAC Name2-fluoro-N-(3-phenyl-1H-indazol-6-yl)benzamide
SMILESO=C(Nc1ccc2c(-c3ccccc3)n[nH]c2c1)c1ccccc1F
InChIInChI=1S/C20H14FN3O/c21-17-9-5-4-8-15(17)20(25)22-14-10-11-16-18(12-14)23-24-19(16)13-6-2-1-3-7-13/h1-12H,(H,22,25)(H,23,24)
InChIKeyZRXZOWPQFZVYPF-UHFFFAOYSA-N
XLogP4.62
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.35
LogP ≤ 54.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-fluorophenyl)-3-phenyl-1H-indazol-6-amine
CID 10171794
N-(4-fluorophenyl)-3-phenyl-1H-indazol-6-amine
CID 10149575
N-[3-(4-fluorophenyl)-1H-indazol-5-yl]-2-methoxybenzamide
CID 22479909
2-fluoro-N-(1H-indazol-5-yl)benzamide
CID 5078247
N-(3H-benzimidazol-5-yl)-2-fluorobenzamide
CID 110724315
4-[(3-phenyl-1H-indazol-5-yl)carbamoyl]benzoic acid
CID 22479735
N-(6-oxo-5H-phenanthridin-3-yl)-2-phenylbenzamide
CID 152653649
2-fluoro-5-(1H-indazole-3-carbonylamino)benzoic acid
CID 170858296
2-fluoro-N-(2-phenyl-1,3-benzoxazol-5-yl)benzamide
CID 718625
N-(4-bromo-3-fluorophenyl)-2-fluorobenzamide
CID 65436517
3-phenyl-N-[4-(trifluoromethyl)phenyl]-1H-indazol-6-amine
CID 10215490
2-fluoro-N-[3-(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)phenyl]benzamide
CID 940632

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(3-phenyl-1H-indazol-6-yl)benzamide?
The IUPAC name of 2-fluoro-N-(3-phenyl-1H-indazol-6-yl)benzamide (CID 117073871) is 2-fluoro-N-(3-phenyl-1H-indazol-6-yl)benzamide.
What is the SMILES notation for 2-fluoro-N-(3-phenyl-1H-indazol-6-yl)benzamide?
The canonical SMILES for 2-fluoro-N-(3-phenyl-1H-indazol-6-yl)benzamide is O=C(Nc1ccc2c(-c3ccccc3)n[nH]c2c1)c1ccccc1F.
What is the InChIKey of 2-fluoro-N-(3-phenyl-1H-indazol-6-yl)benzamide?
The InChIKey is ZRXZOWPQFZVYPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14FN3O/c21-17-9-5-4-8-15(17)20(25)22-14-10-11-16-18(12-14)23-24-19(16)13-6-2-1-3-7-13/h1-12H,(H,22,25)(H,23,24).
What are the key properties of 2-fluoro-N-(3-phenyl-1H-indazol-6-yl)benzamide?
2-fluoro-N-(3-phenyl-1H-indazol-6-yl)benzamide has a molecular weight of 331.35 g/mol, XLogP of 4.62, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(3-phenyl-1H-indazol-6-yl)benzamide is sourced from PubChem (CID 117073871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).