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

C25H25N3O3 — CID 134806396

IUPAC3-[5-[[2-(3-methoxyphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide
SMILESCNC(=O)CCn1ncc2cc(OCc3ccccc3-c3cccc(OC)c3)ccc21
InChIInChI=1S/C25H25N3O3/c1-26-25(29)12-13-28-24-11-10-22(15-20(24)16-27-28)31-17-19-6-3-4-9-23(19)18-7-5-8-21(14-18)30-2/h3-11,14-16H,12-13,17H2,1-2H3,(H,26,29)
InChIKeyQZKFKKSNMWUQPA-UHFFFAOYSA-N
MW415.49 g/mol
LogP4.43
Rot. Bonds8

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

3-[5-[[2-(3-methoxyphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide (PubChem CID 134806396) has the molecular formula C25H25N3O3 and a molecular weight of 415.49 g/mol. Its IUPAC name is 3-[5-[[2-(3-methoxyphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide.

Molecular Properties

Compound Name3-[5-[[2-(3-methoxyphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide
PubChem CID134806396
Molecular FormulaC25H25N3O3
Molecular Weight415.49 g/mol
Exact Mass415.19
IUPAC Name3-[5-[[2-(3-methoxyphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide
SMILESCNC(=O)CCn1ncc2cc(OCc3ccccc3-c3cccc(OC)c3)ccc21
InChIInChI=1S/C25H25N3O3/c1-26-25(29)12-13-28-24-11-10-22(15-20(24)16-27-28)31-17-19-6-3-4-9-23(19)18-7-5-8-21(14-18)30-2/h3-11,14-16H,12-13,17H2,1-2H3,(H,26,29)
InChIKeyQZKFKKSNMWUQPA-UHFFFAOYSA-N
XLogP4.43
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.49
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-[5-[[2-(3-methoxyphenyl)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

Frequently Asked Questions

What is the IUPAC name of 3-[5-[[2-(3-methoxyphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide?
The IUPAC name of 3-[5-[[2-(3-methoxyphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide (CID 134806396) is 3-[5-[[2-(3-methoxyphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide.
What is the SMILES notation for 3-[5-[[2-(3-methoxyphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide?
The canonical SMILES for 3-[5-[[2-(3-methoxyphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide is CNC(=O)CCn1ncc2cc(OCc3ccccc3-c3cccc(OC)c3)ccc21.
What is the InChIKey of 3-[5-[[2-(3-methoxyphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide?
The InChIKey is QZKFKKSNMWUQPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N3O3/c1-26-25(29)12-13-28-24-11-10-22(15-20(24)16-27-28)31-17-19-6-3-4-9-23(19)18-7-5-8-21(14-18)30-2/h3-11,14-16H,12-13,17H2,1-2H3,(H,26,29).
What are the key properties of 3-[5-[[2-(3-methoxyphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide?
3-[5-[[2-(3-methoxyphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide has a molecular weight of 415.49 g/mol, XLogP of 4.43, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-[[2-(3-methoxyphenyl)phenyl]methoxy]indazol-1-yl]-N-methylpropanamide is sourced from PubChem (CID 134806396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).