5-(2,3-difluorophenyl)-N-(7-methyl-7-azaspiro[3.5]nonan-2-yl)-1H-indazole-3-carboxamide

C23H24F2N4O — CID 118381163

IUPAC5-(2,3-difluorophenyl)-N-(7-methyl-7-azaspiro[3.5]nonan-2-yl)-1H-indazole-3-carboxamide
SMILESCN1CCC2(CC1)CC(NC(=O)c1n[nH]c3ccc(-c4cccc(F)c4F)cc13)C2
InChIInChI=1S/C23H24F2N4O/c1-29-9-7-23(8-10-29)12-15(13-23)26-22(30)21-17-11-14(5-6-19(17)27-28-21)16-3-2-4-18(24)20(16)25/h2-6,11,15H,7-10,12-13H2,1H3,(H,26,30)(H,27,28)
InChIKeyOKGPSVZWHNWFMI-UHFFFAOYSA-N
MW410.47 g/mol
LogP4.11
Rot. Bonds3

About 5-(2,3-difluorophenyl)-N-(7-methyl-7-azaspiro[3.5]nonan-2-yl)-1H-indazole-3-carboxamide

5-(2,3-difluorophenyl)-N-(7-methyl-7-azaspiro[3.5]nonan-2-yl)-1H-indazole-3-carboxamide (PubChem CID 118381163) has the molecular formula C23H24F2N4O and a molecular weight of 410.47 g/mol. Its IUPAC name is 5-(2,3-difluorophenyl)-N-(7-methyl-7-azaspiro[3.5]nonan-2-yl)-1H-indazole-3-carboxamide.

Molecular Properties

Compound Name5-(2,3-difluorophenyl)-N-(7-methyl-7-azaspiro[3.5]nonan-2-yl)-1H-indazole-3-carboxamide
PubChem CID118381163
Molecular FormulaC23H24F2N4O
Molecular Weight410.47 g/mol
Exact Mass410.19
IUPAC Name5-(2,3-difluorophenyl)-N-(7-methyl-7-azaspiro[3.5]nonan-2-yl)-1H-indazole-3-carboxamide
SMILESCN1CCC2(CC1)CC(NC(=O)c1n[nH]c3ccc(-c4cccc(F)c4F)cc13)C2
InChIInChI=1S/C23H24F2N4O/c1-29-9-7-23(8-10-29)12-15(13-23)26-22(30)21-17-11-14(5-6-19(17)27-28-21)16-3-2-4-18(24)20(16)25/h2-6,11,15H,7-10,12-13H2,1H3,(H,26,30)(H,27,28)
InChIKeyOKGPSVZWHNWFMI-UHFFFAOYSA-N
XLogP4.11
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.47
LogP ≤ 54.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-(2,3-difluorophenyl)-N-(7-methyl-7-azaspiro[3.5]nonan-2-yl)-1H-indazole-3-carboxamide 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 5-(2,3-difluorophenyl)-N-(7-methyl-7-azaspiro[3.5]nonan-2-yl)-1H-indazole-3-carboxamide?
The IUPAC name of 5-(2,3-difluorophenyl)-N-(7-methyl-7-azaspiro[3.5]nonan-2-yl)-1H-indazole-3-carboxamide (CID 118381163) is 5-(2,3-difluorophenyl)-N-(7-methyl-7-azaspiro[3.5]nonan-2-yl)-1H-indazole-3-carboxamide.
What is the SMILES notation for 5-(2,3-difluorophenyl)-N-(7-methyl-7-azaspiro[3.5]nonan-2-yl)-1H-indazole-3-carboxamide?
The canonical SMILES for 5-(2,3-difluorophenyl)-N-(7-methyl-7-azaspiro[3.5]nonan-2-yl)-1H-indazole-3-carboxamide is CN1CCC2(CC1)CC(NC(=O)c1n[nH]c3ccc(-c4cccc(F)c4F)cc13)C2.
What is the InChIKey of 5-(2,3-difluorophenyl)-N-(7-methyl-7-azaspiro[3.5]nonan-2-yl)-1H-indazole-3-carboxamide?
The InChIKey is OKGPSVZWHNWFMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24F2N4O/c1-29-9-7-23(8-10-29)12-15(13-23)26-22(30)21-17-11-14(5-6-19(17)27-28-21)16-3-2-4-18(24)20(16)25/h2-6,11,15H,7-10,12-13H2,1H3,(H,26,30)(H,27,28).
What are the key properties of 5-(2,3-difluorophenyl)-N-(7-methyl-7-azaspiro[3.5]nonan-2-yl)-1H-indazole-3-carboxamide?
5-(2,3-difluorophenyl)-N-(7-methyl-7-azaspiro[3.5]nonan-2-yl)-1H-indazole-3-carboxamide has a molecular weight of 410.47 g/mol, XLogP of 4.11, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,3-difluorophenyl)-N-(7-methyl-7-azaspiro[3.5]nonan-2-yl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 118381163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).