N-[3-[(dimethylamino)methyl]phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-phenyl-1H-indazole-3-carboxamide;N-[3-(3-fluorophenyl)phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-(5-fluoro-3-pyridinyl)-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide;5-pyridin-3-yl-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide

C109H83F8N23O6 — CID 161330969

IUPACN-[3-[(dimethylamino)methyl]phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-phenyl-1H-indazole-3-carboxamide;N-[3-(3-fluorophenyl)phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-(5-fluoro-3-pyridinyl)-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide;5-pyridin-3-yl-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide
SMILESCN(C)C(=O)Nc1cncc(-c2ccc3[nH]nc(C(=O)Nc4ccccc4)c3c2)c1.CN(C)Cc1cccc(NC(=O)c2n[nH]c3ccc(-c4cccnc4)cc23)c1.O=C(Nc1ccc(C(F)(F)F)cc1)c1n[nH]c2ccc(-c3cccnc3)cc12.O=C(Nc1ccc(C(F)(F)F)cc1)c1n[nH]c2ccc(-c3cncc(F)c3)cc12.O=C(Nc1cccc(-c2cccc(F)c2)c1)c1n[nH]c2ccc(-c3cccnc3)cc12
InChIInChI=1S/C25H17FN4O.C22H20N6O2.C22H21N5O.C20H12F4N4O.C20H13F3N4O/c26-20-7-1-4-16(12-20)17-5-2-8-21(13-17)28-25(31)24-22-14-18(9-10-23(22)29-30-24)19-6-3-11-27-15-19;1-28(2)22(30)25-17-10-15(12-23-13-17)14-8-9-19-18(11-14)20(27-26-19)21(29)24-16-6-4-3-5-7-16;1-27(2)14-15-5-3-7-18(11-15)24-22(28)21-19-12-16(8-9-20(19)25-26-21)17-6-4-10-23-13-17;21-14-7-12(9-25-10-14)11-1-6-17-16(8-11)18(28-27-17)19(29)26-15-4-2-13(3-5-15)20(22,23)24;21-20(22,23)14-4-6-15(7-5-14)25-19(28)18-16-10-12(3-8-17(16)26-27-18)13-2-1-9-24-11-13/h1-15H,(H,28,31)(H,29,30);3-13H,1-2H3,(H,24,29)(H,25,30)(H,26,27);3-13H,14H2,1-2H3,(H,24,28)(H,25,26);1-10H,(H,26,29)(H,27,28);1-11H,(H,25,28)(H,26,27)
InChIKeyVLKHKQLVFIZURJ-UHFFFAOYSA-N
MW1963.00 g/mol
LogP23.52
Rot. Bonds19

About N-[3-[(dimethylamino)methyl]phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-phenyl-1H-indazole-3-carboxamide;N-[3-(3-fluorophenyl)phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-(5-fluoro-3-pyridinyl)-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide;5-pyridin-3-yl-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide

N-[3-[(dimethylamino)methyl]phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-phenyl-1H-indazole-3-carboxamide;N-[3-(3-fluorophenyl)phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-(5-fluoro-3-pyridinyl)-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide;5-pyridin-3-yl-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide (PubChem CID 161330969) has the molecular formula C109H83F8N23O6 and a molecular weight of 1963.00 g/mol. Its IUPAC name is N-[3-[(dimethylamino)methyl]phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-phenyl-1H-indazole-3-carboxamide;N-[3-(3-fluorophenyl)phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-(5-fluoro-3-pyridinyl)-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide;5-pyridin-3-yl-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-[3-[(dimethylamino)methyl]phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-phenyl-1H-indazole-3-carboxamide;N-[3-(3-fluorophenyl)phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-(5-fluoro-3-pyridinyl)-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide;5-pyridin-3-yl-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide
PubChem CID161330969
Molecular FormulaC109H83F8N23O6
Molecular Weight1963.00 g/mol
Exact Mass1961.68
IUPAC NameN-[3-[(dimethylamino)methyl]phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-phenyl-1H-indazole-3-carboxamide;N-[3-(3-fluorophenyl)phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-(5-fluoro-3-pyridinyl)-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide;5-pyridin-3-yl-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide
SMILESCN(C)C(=O)Nc1cncc(-c2ccc3[nH]nc(C(=O)Nc4ccccc4)c3c2)c1.CN(C)Cc1cccc(NC(=O)c2n[nH]c3ccc(-c4cccnc4)cc23)c1.O=C(Nc1ccc(C(F)(F)F)cc1)c1n[nH]c2ccc(-c3cccnc3)cc12.O=C(Nc1ccc(C(F)(F)F)cc1)c1n[nH]c2ccc(-c3cncc(F)c3)cc12.O=C(Nc1cccc(-c2cccc(F)c2)c1)c1n[nH]c2ccc(-c3cccnc3)cc12
InChIInChI=1S/C25H17FN4O.C22H20N6O2.C22H21N5O.C20H12F4N4O.C20H13F3N4O/c26-20-7-1-4-16(12-20)17-5-2-8-21(13-17)28-25(31)24-22-14-18(9-10-23(22)29-30-24)19-6-3-11-27-15-19;1-28(2)22(30)25-17-10-15(12-23-13-17)14-8-9-19-18(11-14)20(27-26-19)21(29)24-16-6-4-3-5-7-16;1-27(2)14-15-5-3-7-18(11-15)24-22(28)21-19-12-16(8-9-20(19)25-26-21)17-6-4-10-23-13-17;21-14-7-12(9-25-10-14)11-1-6-17-16(8-11)18(28-27-17)19(29)26-15-4-2-13(3-5-15)20(22,23)24;21-20(22,23)14-4-6-15(7-5-14)25-19(28)18-16-10-12(3-8-17(16)26-27-18)13-2-1-9-24-11-13/h1-15H,(H,28,31)(H,29,30);3-13H,1-2H3,(H,24,29)(H,25,30)(H,26,27);3-13H,14H2,1-2H3,(H,24,28)(H,25,26);1-10H,(H,26,29)(H,27,28);1-11H,(H,25,28)(H,26,27)
InChIKeyVLKHKQLVFIZURJ-UHFFFAOYSA-N
XLogP23.52
TPSA388.93 Ų
H-Bond Donors11
H-Bond Acceptors17
Rotatable Bonds19
Heavy Atoms146
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001963.00
LogP ≤ 523.52
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1017

Analyze N-[3-[(dimethylamino)methyl]phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-phenyl-1H-indazole-3-carboxamide;N-[3-(3-fluorophenyl)phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-(5-fluoro-3-pyridinyl)-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide;5-pyridin-3-yl-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[3-[(dimethylamino)methyl]phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-phenyl-1H-indazole-3-carboxamide;N-[3-(3-fluorophenyl)phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-(5-fluoro-3-pyridinyl)-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide;5-pyridin-3-yl-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide?
The IUPAC name of N-[3-[(dimethylamino)methyl]phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-phenyl-1H-indazole-3-carboxamide;N-[3-(3-fluorophenyl)phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-(5-fluoro-3-pyridinyl)-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide;5-pyridin-3-yl-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide (CID 161330969) is N-[3-[(dimethylamino)methyl]phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-phenyl-1H-indazole-3-carboxamide;N-[3-(3-fluorophenyl)phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-(5-fluoro-3-pyridinyl)-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide;5-pyridin-3-yl-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide.
What is the SMILES notation for N-[3-[(dimethylamino)methyl]phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-phenyl-1H-indazole-3-carboxamide;N-[3-(3-fluorophenyl)phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-(5-fluoro-3-pyridinyl)-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide;5-pyridin-3-yl-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide?
The canonical SMILES for N-[3-[(dimethylamino)methyl]phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-phenyl-1H-indazole-3-carboxamide;N-[3-(3-fluorophenyl)phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-(5-fluoro-3-pyridinyl)-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide;5-pyridin-3-yl-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide is CN(C)C(=O)Nc1cncc(-c2ccc3[nH]nc(C(=O)Nc4ccccc4)c3c2)c1.CN(C)Cc1cccc(NC(=O)c2n[nH]c3ccc(-c4cccnc4)cc23)c1.O=C(Nc1ccc(C(F)(F)F)cc1)c1n[nH]c2ccc(-c3cccnc3)cc12.O=C(Nc1ccc(C(F)(F)F)cc1)c1n[nH]c2ccc(-c3cncc(F)c3)cc12.O=C(Nc1cccc(-c2cccc(F)c2)c1)c1n[nH]c2ccc(-c3cccnc3)cc12.
What is the InChIKey of N-[3-[(dimethylamino)methyl]phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-phenyl-1H-indazole-3-carboxamide;N-[3-(3-fluorophenyl)phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-(5-fluoro-3-pyridinyl)-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide;5-pyridin-3-yl-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide?
The InChIKey is VLKHKQLVFIZURJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H17FN4O.C22H20N6O2.C22H21N5O.C20H12F4N4O.C20H13F3N4O/c26-20-7-1-4-16(12-20)17-5-2-8-21(13-17)28-25(31)24-22-14-18(9-10-23(22)29-30-24)19-6-3-11-27-15-19;1-28(2)22(30)25-17-10-15(12-23-13-17)14-8-9-19-18(11-14)20(27-26-19)21(29)24-16-6-4-3-5-7-16;1-27(2)14-15-5-3-7-18(11-15)24-22(28)21-19-12-16(8-9-20(19)25-26-21)17-6-4-10-23-13-17;21-14-7-12(9-25-10-14)11-1-6-17-16(8-11)18(28-27-17)19(29)26-15-4-2-13(3-5-15)20(22,23)24;21-20(22,23)14-4-6-15(7-5-14)25-19(28)18-16-10-12(3-8-17(16)26-27-18)13-2-1-9-24-11-13/h1-15H,(H,28,31)(H,29,30);3-13H,1-2H3,(H,24,29)(H,25,30)(H,26,27);3-13H,14H2,1-2H3,(H,24,28)(H,25,26);1-10H,(H,26,29)(H,27,28);1-11H,(H,25,28)(H,26,27).
What are the key properties of N-[3-[(dimethylamino)methyl]phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-phenyl-1H-indazole-3-carboxamide;N-[3-(3-fluorophenyl)phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-(5-fluoro-3-pyridinyl)-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide;5-pyridin-3-yl-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide?
N-[3-[(dimethylamino)methyl]phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-phenyl-1H-indazole-3-carboxamide;N-[3-(3-fluorophenyl)phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-(5-fluoro-3-pyridinyl)-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide;5-pyridin-3-yl-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide has a molecular weight of 1963.00 g/mol, XLogP of 23.52, 19 rotatable bonds, 11 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(dimethylamino)methyl]phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-phenyl-1H-indazole-3-carboxamide;N-[3-(3-fluorophenyl)phenyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide;5-(5-fluoro-3-pyridinyl)-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide;5-pyridin-3-yl-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide is sourced from PubChem (CID 161330969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).