N-[5-[(3,5-difluorophenyl)methoxy]-1H-indazol-3-yl]benzamide

C21H15F2N3O2 — CID 58513794

IUPACN-[5-[(3,5-difluorophenyl)methoxy]-1H-indazol-3-yl]benzamide
SMILESO=C(Nc1n[nH]c2ccc(OCc3cc(F)cc(F)c3)cc12)c1ccccc1
InChIInChI=1S/C21H15F2N3O2/c22-15-8-13(9-16(23)10-15)12-28-17-6-7-19-18(11-17)20(26-25-19)24-21(27)14-4-2-1-3-5-14/h1-11H,12H2,(H2,24,25,26,27)
InChIKeyWKWRFIXGONAKAA-UHFFFAOYSA-N
MW379.37 g/mol
LogP4.67
Rot. Bonds5

About N-[5-[(3,5-difluorophenyl)methoxy]-1H-indazol-3-yl]benzamide

N-[5-[(3,5-difluorophenyl)methoxy]-1H-indazol-3-yl]benzamide (PubChem CID 58513794) has the molecular formula C21H15F2N3O2 and a molecular weight of 379.37 g/mol. Its IUPAC name is N-[5-[(3,5-difluorophenyl)methoxy]-1H-indazol-3-yl]benzamide.

Molecular Properties

Compound NameN-[5-[(3,5-difluorophenyl)methoxy]-1H-indazol-3-yl]benzamide
PubChem CID58513794
Molecular FormulaC21H15F2N3O2
Molecular Weight379.37 g/mol
Exact Mass379.11
IUPAC NameN-[5-[(3,5-difluorophenyl)methoxy]-1H-indazol-3-yl]benzamide
SMILESO=C(Nc1n[nH]c2ccc(OCc3cc(F)cc(F)c3)cc12)c1ccccc1
InChIInChI=1S/C21H15F2N3O2/c22-15-8-13(9-16(23)10-15)12-28-17-6-7-19-18(11-17)20(26-25-19)24-21(27)14-4-2-1-3-5-14/h1-11H,12H2,(H2,24,25,26,27)
InChIKeyWKWRFIXGONAKAA-UHFFFAOYSA-N
XLogP4.67
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.37
LogP ≤ 54.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[5-[(3,5-difluorophenyl)methoxy]-1H-indazol-3-yl]benzamide 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-[5-[(3,5-difluorophenyl)methoxy]-1H-indazol-3-yl]benzamide?
The IUPAC name of N-[5-[(3,5-difluorophenyl)methoxy]-1H-indazol-3-yl]benzamide (CID 58513794) is N-[5-[(3,5-difluorophenyl)methoxy]-1H-indazol-3-yl]benzamide.
What is the SMILES notation for N-[5-[(3,5-difluorophenyl)methoxy]-1H-indazol-3-yl]benzamide?
The canonical SMILES for N-[5-[(3,5-difluorophenyl)methoxy]-1H-indazol-3-yl]benzamide is O=C(Nc1n[nH]c2ccc(OCc3cc(F)cc(F)c3)cc12)c1ccccc1.
What is the InChIKey of N-[5-[(3,5-difluorophenyl)methoxy]-1H-indazol-3-yl]benzamide?
The InChIKey is WKWRFIXGONAKAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15F2N3O2/c22-15-8-13(9-16(23)10-15)12-28-17-6-7-19-18(11-17)20(26-25-19)24-21(27)14-4-2-1-3-5-14/h1-11H,12H2,(H2,24,25,26,27).
What are the key properties of N-[5-[(3,5-difluorophenyl)methoxy]-1H-indazol-3-yl]benzamide?
N-[5-[(3,5-difluorophenyl)methoxy]-1H-indazol-3-yl]benzamide has a molecular weight of 379.37 g/mol, XLogP of 4.67, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[(3,5-difluorophenyl)methoxy]-1H-indazol-3-yl]benzamide is sourced from PubChem (CID 58513794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).