3-[5-[[2-(5-fluoro-2-methylphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide

C25H24FN3O2 — CID 134807326

IUPAC3-[5-[[2-(5-fluoro-2-methylphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide
SMILESCNC(=O)CCn1ncc2cc(OCc3ccccc3-c3cc(F)ccc3C)ccc21
InChIInChI=1S/C25H24FN3O2/c1-17-7-8-20(26)14-23(17)22-6-4-3-5-18(22)16-31-21-9-10-24-19(13-21)15-28-29(24)12-11-25(30)27-2/h3-10,13-15H,11-12,16H2,1-2H3,(H,27,30)
InChIKeyXCWGTVPAXYKJMX-UHFFFAOYSA-N
MW417.48 g/mol
LogP4.87
Rot. Bonds7

About 3-[5-[[2-(5-fluoro-2-methylphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide

3-[5-[[2-(5-fluoro-2-methylphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide (PubChem CID 134807326) has the molecular formula C25H24FN3O2 and a molecular weight of 417.48 g/mol. Its IUPAC name is 3-[5-[[2-(5-fluoro-2-methylphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide.

Molecular Properties

Compound Name3-[5-[[2-(5-fluoro-2-methylphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide
PubChem CID134807326
Molecular FormulaC25H24FN3O2
Molecular Weight417.48 g/mol
Exact Mass417.19
IUPAC Name3-[5-[[2-(5-fluoro-2-methylphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide
SMILESCNC(=O)CCn1ncc2cc(OCc3ccccc3-c3cc(F)ccc3C)ccc21
InChIInChI=1S/C25H24FN3O2/c1-17-7-8-20(26)14-23(17)22-6-4-3-5-18(22)16-31-21-9-10-24-19(13-21)15-28-29(24)12-11-25(30)27-2/h3-10,13-15H,11-12,16H2,1-2H3,(H,27,30)
InChIKeyXCWGTVPAXYKJMX-UHFFFAOYSA-N
XLogP4.87
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.48
LogP ≤ 54.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-[5-[[2-(5-fluoro-2-methylphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide with MolForge

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

Launch Full Analysis

Related Compounds

2,2,2-trifluoro-N-((1S,2R)-2-((1-(4-fluorophenyl)-1H-indazol-5-yl)oxy)-2-(3-methoxyphenyl)-1-methylethyl)acetamide
CID 24825740
Merestinib
CID 44603533
Mizacorat
CID 121248172
2,2,2-Trifluoro-N-[(1r,2s)-1-{[1-(4-Fluorophenyl)-1h-Indazol-5-Yl]oxy}-1-Phenylpropan-2-Yl]acetamide
CID 25013322
Azd-2906
CID 25013811
Methyl 2-[3-(2-fluoro-5-phenylmethoxyphenyl)indazol-1-yl]acetate
CID 73506474
Methyl 2-[3-[5-(3-cyclohexylpropoxy)-2-fluorophenyl]indazol-1-yl]acetate
CID 73507350
N-[(1R,2S)-1-[1-(4-fluorophenyl)indazol-5-yl]oxy-1-phenyl-propan-2-yl]-2,2-dimethyl-propanamide
CID 25011854
2,2,2-trifluoro-N-[(1R,2S)-1-[1-(4-fluorophenyl)indazol-5-yl]oxy-1-(3-hydroxyphenyl)propan-2-yl]acetamide
CID 25012028
N-[(1R,2S)-1-(4-ethylphenyl)-1-[1-(4-fluorophenyl)indazol-5-yl]oxy-propan-2-yl]-2,2-dimethyl-propanamide
CID 25012190
N-((1S,2R)-2-{[1-(4-fluorophenyl)-1H-indazol-5-yl]oxy}-1-methyl-2-phenylethyl)cyclopropanecarboxamide
CID 25013321
N-((1R,2S)-1-(1-(4-fluorophenyl)-1H-indazol-5-yloxy)-1-(4-methoxyphenyl)propan-2-yl)pivalamide
CID 25013326

Frequently Asked Questions

What is the IUPAC name of 3-[5-[[2-(5-fluoro-2-methylphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide?
The IUPAC name of 3-[5-[[2-(5-fluoro-2-methylphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide (CID 134807326) is 3-[5-[[2-(5-fluoro-2-methylphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide.
What is the SMILES notation for 3-[5-[[2-(5-fluoro-2-methylphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide?
The canonical SMILES for 3-[5-[[2-(5-fluoro-2-methylphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide is CNC(=O)CCn1ncc2cc(OCc3ccccc3-c3cc(F)ccc3C)ccc21.
What is the InChIKey of 3-[5-[[2-(5-fluoro-2-methylphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide?
The InChIKey is XCWGTVPAXYKJMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24FN3O2/c1-17-7-8-20(26)14-23(17)22-6-4-3-5-18(22)16-31-21-9-10-24-19(13-21)15-28-29(24)12-11-25(30)27-2/h3-10,13-15H,11-12,16H2,1-2H3,(H,27,30).
What are the key properties of 3-[5-[[2-(5-fluoro-2-methylphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide?
3-[5-[[2-(5-fluoro-2-methylphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide has a molecular weight of 417.48 g/mol, XLogP of 4.87, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-[[2-(5-fluoro-2-methylphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide is sourced from PubChem (CID 134807326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).