N,N-dimethyl-1-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]methanamine;2-phenyl-N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]acetamide;N-propan-2-yl-5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]pyridin-3-amine;N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]benzamide

C117H90N28O2 — CID 159554549

IUPACN,N-dimethyl-1-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]methanamine;2-phenyl-N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]acetamide;N-propan-2-yl-5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]pyridin-3-amine;N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]benzamide
SMILESCC(C)Nc1cncc(-c2ccc3[nH]nc(-c4nc5c(-c6cccnc6)cccc5[nH]4)c3c2)c1.CN(C)Cc1cncc(-c2ccc3[nH]nc(-c4nc5c(-c6cccnc6)cccc5[nH]4)c3c2)c1.O=C(Cc1ccccc1)Nc1cncc(-c2ccc3[nH]nc(-c4nc5c(-c6cccnc6)cccc5[nH]4)c3c2)c1.O=C(Nc1cncc(-c2ccc3[nH]nc(-c4nc5c(-c6cccnc6)cccc5[nH]4)c3c2)c1)c1ccccc1
InChIInChI=1S/C32H23N7O.C31H21N7O.2C27H23N7/c40-29(14-20-6-2-1-3-7-20)35-24-15-23(18-34-19-24)21-11-12-27-26(16-21)31(39-38-27)32-36-28-10-4-9-25(30(28)37-32)22-8-5-13-33-17-22;39-31(19-6-2-1-3-7-19)34-23-14-22(17-33-18-23)20-11-12-26-25(15-20)29(38-37-26)30-35-27-10-4-9-24(28(27)36-30)21-8-5-13-32-16-21;1-34(2)16-17-11-20(15-29-13-17)18-8-9-23-22(12-18)26(33-32-23)27-30-24-7-3-6-21(25(24)31-27)19-5-4-10-28-14-19;1-16(2)30-20-11-19(14-29-15-20)17-8-9-23-22(12-17)26(34-33-23)27-31-24-7-3-6-21(25(24)32-27)18-5-4-10-28-13-18/h1-13,15-19H,14H2,(H,35,40)(H,36,37)(H,38,39);1-18H,(H,34,39)(H,35,36)(H,37,38);3-15H,16H2,1-2H3,(H,30,31)(H,32,33);3-16,30H,1-2H3,(H,31,32)(H,33,34)
InChIKeyMFUYYBSZGFHYFJ-UHFFFAOYSA-N
MW1920.20 g/mol
LogP24.24
Rot. Bonds21

About N,N-dimethyl-1-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]methanamine;2-phenyl-N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]acetamide;N-propan-2-yl-5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]pyridin-3-amine;N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]benzamide

N,N-dimethyl-1-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]methanamine;2-phenyl-N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]acetamide;N-propan-2-yl-5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]pyridin-3-amine;N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]benzamide (PubChem CID 159554549) has the molecular formula C117H90N28O2 and a molecular weight of 1920.20 g/mol. Its IUPAC name is N,N-dimethyl-1-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]methanamine;2-phenyl-N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]acetamide;N-propan-2-yl-5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]pyridin-3-amine;N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]benzamide.

Molecular Properties

Compound NameN,N-dimethyl-1-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]methanamine;2-phenyl-N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]acetamide;N-propan-2-yl-5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]pyridin-3-amine;N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]benzamide
PubChem CID159554549
Molecular FormulaC117H90N28O2
Molecular Weight1920.20 g/mol
Exact Mass1918.78
IUPAC NameN,N-dimethyl-1-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]methanamine;2-phenyl-N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]acetamide;N-propan-2-yl-5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]pyridin-3-amine;N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]benzamide
SMILESCC(C)Nc1cncc(-c2ccc3[nH]nc(-c4nc5c(-c6cccnc6)cccc5[nH]4)c3c2)c1.CN(C)Cc1cncc(-c2ccc3[nH]nc(-c4nc5c(-c6cccnc6)cccc5[nH]4)c3c2)c1.O=C(Cc1ccccc1)Nc1cncc(-c2ccc3[nH]nc(-c4nc5c(-c6cccnc6)cccc5[nH]4)c3c2)c1.O=C(Nc1cncc(-c2ccc3[nH]nc(-c4nc5c(-c6cccnc6)cccc5[nH]4)c3c2)c1)c1ccccc1
InChIInChI=1S/C32H23N7O.C31H21N7O.2C27H23N7/c40-29(14-20-6-2-1-3-7-20)35-24-15-23(18-34-19-24)21-11-12-27-26(16-21)31(39-38-27)32-36-28-10-4-9-25(30(28)37-32)22-8-5-13-33-17-22;39-31(19-6-2-1-3-7-19)34-23-14-22(17-33-18-23)20-11-12-26-25(15-20)29(38-37-26)30-35-27-10-4-9-24(28(27)36-30)21-8-5-13-32-16-21;1-34(2)16-17-11-20(15-29-13-17)18-8-9-23-22(12-18)26(33-32-23)27-30-24-7-3-6-21(25(24)31-27)19-5-4-10-28-14-19;1-16(2)30-20-11-19(14-29-15-20)17-8-9-23-22(12-17)26(34-33-23)27-31-24-7-3-6-21(25(24)32-27)18-5-4-10-28-13-18/h1-13,15-19H,14H2,(H,35,40)(H,36,37)(H,38,39);1-18H,(H,34,39)(H,35,36)(H,37,38);3-15H,16H2,1-2H3,(H,30,31)(H,32,33);3-16,30H,1-2H3,(H,31,32)(H,33,34)
InChIKeyMFUYYBSZGFHYFJ-UHFFFAOYSA-N
XLogP24.24
TPSA406.03 Ų
H-Bond Donors11
H-Bond Acceptors20
Rotatable Bonds21
Heavy Atoms147
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001920.20
LogP ≤ 524.24
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1020

Analyze N,N-dimethyl-1-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]methanamine;2-phenyl-N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]acetamide;N-propan-2-yl-5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]pyridin-3-amine;N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]benzamide with MolForge

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Related Compounds

N,N-dimethyl-1-[5-[3-(7-pyridin-2-yl-3H-imidazo[4,5-c]pyridin-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]methanamine;2-phenyl-N-[5-[3-(7-pyridin-2-yl-3H-imidazo[4,5-c]pyridin-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]acetamide;N-propan-2-yl-5-[3-(7-pyridin-2-yl-3H-imidazo[4,5-c]pyridin-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]pyridin-3-amine;N-[5-[3-(7-pyridin-2-yl-3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazolo[5,4-b]pyridin-5-yl]-3-pyridinyl]benzamide
CID 160680320
N-[5-[3-[4-(3-fluorophenyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]-3-pyridinyl]benzamide;N-[5-[3-[4-(3-fluorophenyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]-3-pyridinyl]butanamide;N-[5-[3-[4-(3-fluorophenyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]-3-pyridinyl]-3,3-dimethylbutanamide;N-[5-[3-[4-(3-fluorophenyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]-3-pyridinyl]pentanamide;N-[5-[3-[4-(3-fluorophenyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]-3-pyridinyl]-2-phenylacetamide
CID 161212646
N,N-dimethyl-1-[5-[3-[7-(4-methylimidazol-1-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]methanamine;5-[3-[7-(4-methylimidazol-1-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-N-propan-2-ylpyridin-3-amine;N-[5-[3-[7-(4-methylimidazol-1-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-1H-pyrazolo[5,4-b]pyridin-5-yl]-3-pyridinyl]benzamide;N-[5-[3-[7-(4-methylimidazol-1-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]-2-phenylacetamide
CID 158929452
2,2-dimethyl-N-[5-[3-[7-(4-methylpiperazin-1-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-1H-indazol-5-yl]-3-pyridinyl]propanamide;methane;5-[3-[7-(4-methylpiperazin-1-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-1H-indazol-5-yl]-N-propan-2-ylpyridin-3-amine;N-[5-[3-[7-(4-methylpiperazin-1-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-1H-indazol-5-yl]-3-pyridinyl]benzamide;N-[5-[3-[7-(4-methylpiperazin-1-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-1H-indazol-5-yl]-3-pyridinyl]-2-phenylacetamide
CID 157105909
3-methyl-N-[5-[3-(7-pyridin-3-yl-3H-imidazo[4,5-c]pyridin-2-yl)-1H-indazol-5-yl]-3-pyridinyl]butanamide
CID 135987322
N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]benzamide
CID 137143286
2-(dimethylamino)-N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-pyrazolo[3,4-c]pyridin-5-yl]-3-pyridinyl]acetamide
CID 136943378
2-(dimethylamino)-N-[5-[3-(4-pyridin-3-yl-1H-imidazo[4,5-c]pyridin-2-yl)-1H-indazol-5-yl]-3-pyridinyl]acetamide
CID 136937208
N-[5-[3-(4-pyridin-4-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]butanamide
CID 136509495
N-[5-[4-fluoro-3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-pyrazolo[3,4-c]pyridin-5-yl]-3-pyridinyl]-2-phenylacetamide
CID 136942542
1-[5-[3-[4-(furan-3-yl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]-3-pyridinyl]-N,N-dimethylmethanamine
CID 136509608
N-[5-[3-(7-pyridin-3-yl-3H-imidazo[4,5-c]pyridin-2-yl)-1H-indazol-5-yl]-3-pyridinyl]propanamide
CID 135987310

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]methanamine;2-phenyl-N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]acetamide;N-propan-2-yl-5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]pyridin-3-amine;N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]benzamide?
The IUPAC name of N,N-dimethyl-1-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]methanamine;2-phenyl-N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]acetamide;N-propan-2-yl-5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]pyridin-3-amine;N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]benzamide (CID 159554549) is N,N-dimethyl-1-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]methanamine;2-phenyl-N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]acetamide;N-propan-2-yl-5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]pyridin-3-amine;N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]benzamide.
What is the SMILES notation for N,N-dimethyl-1-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]methanamine;2-phenyl-N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]acetamide;N-propan-2-yl-5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]pyridin-3-amine;N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]benzamide?
The canonical SMILES for N,N-dimethyl-1-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]methanamine;2-phenyl-N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]acetamide;N-propan-2-yl-5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]pyridin-3-amine;N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]benzamide is CC(C)Nc1cncc(-c2ccc3[nH]nc(-c4nc5c(-c6cccnc6)cccc5[nH]4)c3c2)c1.CN(C)Cc1cncc(-c2ccc3[nH]nc(-c4nc5c(-c6cccnc6)cccc5[nH]4)c3c2)c1.O=C(Cc1ccccc1)Nc1cncc(-c2ccc3[nH]nc(-c4nc5c(-c6cccnc6)cccc5[nH]4)c3c2)c1.O=C(Nc1cncc(-c2ccc3[nH]nc(-c4nc5c(-c6cccnc6)cccc5[nH]4)c3c2)c1)c1ccccc1.
What is the InChIKey of N,N-dimethyl-1-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]methanamine;2-phenyl-N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]acetamide;N-propan-2-yl-5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]pyridin-3-amine;N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]benzamide?
The InChIKey is MFUYYBSZGFHYFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H23N7O.C31H21N7O.2C27H23N7/c40-29(14-20-6-2-1-3-7-20)35-24-15-23(18-34-19-24)21-11-12-27-26(16-21)31(39-38-27)32-36-28-10-4-9-25(30(28)37-32)22-8-5-13-33-17-22;39-31(19-6-2-1-3-7-19)34-23-14-22(17-33-18-23)20-11-12-26-25(15-20)29(38-37-26)30-35-27-10-4-9-24(28(27)36-30)21-8-5-13-32-16-21;1-34(2)16-17-11-20(15-29-13-17)18-8-9-23-22(12-18)26(33-32-23)27-30-24-7-3-6-21(25(24)31-27)19-5-4-10-28-14-19;1-16(2)30-20-11-19(14-29-15-20)17-8-9-23-22(12-17)26(34-33-23)27-31-24-7-3-6-21(25(24)32-27)18-5-4-10-28-13-18/h1-13,15-19H,14H2,(H,35,40)(H,36,37)(H,38,39);1-18H,(H,34,39)(H,35,36)(H,37,38);3-15H,16H2,1-2H3,(H,30,31)(H,32,33);3-16,30H,1-2H3,(H,31,32)(H,33,34).
What are the key properties of N,N-dimethyl-1-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]methanamine;2-phenyl-N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]acetamide;N-propan-2-yl-5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]pyridin-3-amine;N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]benzamide?
N,N-dimethyl-1-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]methanamine;2-phenyl-N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]acetamide;N-propan-2-yl-5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]pyridin-3-amine;N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]benzamide has a molecular weight of 1920.20 g/mol, XLogP of 24.24, 21 rotatable bonds, 11 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]methanamine;2-phenyl-N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]acetamide;N-propan-2-yl-5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]pyridin-3-amine;N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]benzamide is sourced from PubChem (CID 159554549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).