N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-2-phenylmethoxyacetamide

C23H20FN3O3 — CID 69064500

IUPACN-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-2-phenylmethoxyacetamide
SMILESCOc1ccc(F)cc1-c1ccc2c(NC(=O)COCc3ccccc3)n[nH]c2c1
InChIInChI=1S/C23H20FN3O3/c1-29-21-10-8-17(24)12-19(21)16-7-9-18-20(11-16)26-27-23(18)25-22(28)14-30-13-15-5-3-2-4-6-15/h2-12H,13-14H2,1H3,(H2,25,26,27,28)
InChIKeyWRHATTJIZZDKLJ-UHFFFAOYSA-N
MW405.43 g/mol
LogP4.53
Rot. Bonds7

About N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-2-phenylmethoxyacetamide

N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-2-phenylmethoxyacetamide (PubChem CID 69064500) has the molecular formula C23H20FN3O3 and a molecular weight of 405.43 g/mol. Its IUPAC name is N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-2-phenylmethoxyacetamide.

Molecular Properties

Compound NameN-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-2-phenylmethoxyacetamide
PubChem CID69064500
Molecular FormulaC23H20FN3O3
Molecular Weight405.43 g/mol
Exact Mass405.15
IUPAC NameN-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-2-phenylmethoxyacetamide
SMILESCOc1ccc(F)cc1-c1ccc2c(NC(=O)COCc3ccccc3)n[nH]c2c1
InChIInChI=1S/C23H20FN3O3/c1-29-21-10-8-17(24)12-19(21)16-7-9-18-20(11-16)26-27-23(18)25-22(28)14-30-13-15-5-3-2-4-6-15/h2-12H,13-14H2,1H3,(H2,25,26,27,28)
InChIKeyWRHATTJIZZDKLJ-UHFFFAOYSA-N
XLogP4.53
TPSA76.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.43
LogP ≤ 54.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-2-phenylmethoxyacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-2-phenylmethoxyacetamide?
The IUPAC name of N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-2-phenylmethoxyacetamide (CID 69064500) is N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-2-phenylmethoxyacetamide.
What is the SMILES notation for N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-2-phenylmethoxyacetamide?
The canonical SMILES for N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-2-phenylmethoxyacetamide is COc1ccc(F)cc1-c1ccc2c(NC(=O)COCc3ccccc3)n[nH]c2c1.
What is the InChIKey of N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-2-phenylmethoxyacetamide?
The InChIKey is WRHATTJIZZDKLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20FN3O3/c1-29-21-10-8-17(24)12-19(21)16-7-9-18-20(11-16)26-27-23(18)25-22(28)14-30-13-15-5-3-2-4-6-15/h2-12H,13-14H2,1H3,(H2,25,26,27,28).
What are the key properties of N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-2-phenylmethoxyacetamide?
N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-2-phenylmethoxyacetamide has a molecular weight of 405.43 g/mol, XLogP of 4.53, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-2-phenylmethoxyacetamide is sourced from PubChem (CID 69064500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).