3-[(5,8-dichloronaphthalen-2-yl)methyl]-2H-pyrazolo[4,3-b]pyridine;1-(3,3-difluorobutan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;1-ethyl-3-methyl-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine

C120H89Cl2F12N31 — CID 157274566

IUPAC3-[(5,8-dichloronaphthalen-2-yl)methyl]-2H-pyrazolo[4,3-b]pyridine;1-(3,3-difluorobutan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;1-ethyl-3-methyl-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine
SMILESCC(c1nccc2cc(Nc3n[nH]c4cccnc34)ccc12)C(C)(F)F.CCc1nc(C)cc2cc(Nc3n[nH]c4cccnc34)ccc12.Clc1ccc(Cl)c2cc(Cc3[nH]nc4cccnc34)ccc12.FC(F)(F)c1cccc2cc(Nc3[nH]nc4ncccc34)ccc12.FC(F)(F)c1cccc2cc(Nc3[nH]nc4nccnc34)ccc12.FC(F)c1cccc2cc(Nc3[nH]nc4nccnc34)ccc12.FC(F)c1cccc2cc(Nc3n[nH]c4cccnc34)ccc12
InChIInChI=1S/C19H17F2N5.C18H17N5.C17H11Cl2N3.C17H11F3N4.C17H12F2N4.C16H10F3N5.C16H11F2N5/c1-11(19(2,20)21)16-14-6-5-13(10-12(14)7-9-23-16)24-18-17-15(25-26-18)4-3-8-22-17;1-3-15-14-7-6-13(10-12(14)9-11(2)20-15)21-18-17-16(22-23-18)5-4-8-19-17;18-13-5-6-14(19)12-8-10(3-4-11(12)13)9-16-17-15(21-22-16)2-1-7-20-17;18-17(19,20)14-5-1-3-10-9-11(6-7-12(10)14)22-16-13-4-2-8-21-15(13)23-24-16;18-16(19)13-4-1-3-10-9-11(6-7-12(10)13)21-17-15-14(22-23-17)5-2-8-20-15;17-16(18,19)12-3-1-2-9-8-10(4-5-11(9)12)22-15-13-14(23-24-15)21-7-6-20-13;17-14(18)12-3-1-2-9-8-10(4-5-11(9)12)21-16-13-15(22-23-16)20-7-6-19-13/h3-11H,1-2H3,(H2,24,25,26);4-10H,3H2,1-2H3,(H2,21,22,23);1-8H,9H2,(H,21,22);1-9H,(H2,21,22,23,24);1-9,16H,(H2,21,22,23);1-8H,(H2,21,22,23,24);1-8,14H,(H2,20,21,22,23)
InChIKeyAYYCDHCQHFVPEM-UHFFFAOYSA-N
MW2264.13 g/mol
LogP32.26
Rot. Bonds19

About 3-[(5,8-dichloronaphthalen-2-yl)methyl]-2H-pyrazolo[4,3-b]pyridine;1-(3,3-difluorobutan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;1-ethyl-3-methyl-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine

3-[(5,8-dichloronaphthalen-2-yl)methyl]-2H-pyrazolo[4,3-b]pyridine;1-(3,3-difluorobutan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;1-ethyl-3-methyl-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine (PubChem CID 157274566) has the molecular formula C120H89Cl2F12N31 and a molecular weight of 2264.13 g/mol. Its IUPAC name is 3-[(5,8-dichloronaphthalen-2-yl)methyl]-2H-pyrazolo[4,3-b]pyridine;1-(3,3-difluorobutan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;1-ethyl-3-methyl-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine.

Molecular Properties

Compound Name3-[(5,8-dichloronaphthalen-2-yl)methyl]-2H-pyrazolo[4,3-b]pyridine;1-(3,3-difluorobutan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;1-ethyl-3-methyl-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine
PubChem CID157274566
Molecular FormulaC120H89Cl2F12N31
Molecular Weight2264.13 g/mol
Exact Mass2261.71
IUPAC Name3-[(5,8-dichloronaphthalen-2-yl)methyl]-2H-pyrazolo[4,3-b]pyridine;1-(3,3-difluorobutan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;1-ethyl-3-methyl-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine
SMILESCC(c1nccc2cc(Nc3n[nH]c4cccnc34)ccc12)C(C)(F)F.CCc1nc(C)cc2cc(Nc3n[nH]c4cccnc34)ccc12.Clc1ccc(Cl)c2cc(Cc3[nH]nc4cccnc34)ccc12.FC(F)(F)c1cccc2cc(Nc3[nH]nc4ncccc34)ccc12.FC(F)(F)c1cccc2cc(Nc3[nH]nc4nccnc34)ccc12.FC(F)c1cccc2cc(Nc3[nH]nc4nccnc34)ccc12.FC(F)c1cccc2cc(Nc3n[nH]c4cccnc34)ccc12
InChIInChI=1S/C19H17F2N5.C18H17N5.C17H11Cl2N3.C17H11F3N4.C17H12F2N4.C16H10F3N5.C16H11F2N5/c1-11(19(2,20)21)16-14-6-5-13(10-12(14)7-9-23-16)24-18-17-15(25-26-18)4-3-8-22-17;1-3-15-14-7-6-13(10-12(14)9-11(2)20-15)21-18-17-16(22-23-18)5-4-8-19-17;18-13-5-6-14(19)12-8-10(3-4-11(12)13)9-16-17-15(21-22-16)2-1-7-20-17;18-17(19,20)14-5-1-3-10-9-11(6-7-12(10)14)22-16-13-4-2-8-21-15(13)23-24-16;18-16(19)13-4-1-3-10-9-11(6-7-12(10)13)21-17-15-14(22-23-17)5-2-8-20-15;17-16(18,19)12-3-1-2-9-8-10(4-5-11(9)12)22-15-13-14(23-24-15)21-7-6-20-13;17-14(18)12-3-1-2-9-8-10(4-5-11(9)12)21-16-13-15(22-23-16)20-7-6-19-13/h3-11H,1-2H3,(H2,24,25,26);4-10H,3H2,1-2H3,(H2,21,22,23);1-8H,9H2,(H,21,22);1-9H,(H2,21,22,23,24);1-9,16H,(H2,21,22,23);1-8H,(H2,21,22,23,24);1-8,14H,(H2,20,21,22,23)
InChIKeyAYYCDHCQHFVPEM-UHFFFAOYSA-N
XLogP32.26
TPSA414.73 Ų
H-Bond Donors13
H-Bond Acceptors24
Rotatable Bonds19
Heavy Atoms165
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002264.13
LogP ≤ 532.26
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1024

Analyze 3-[(5,8-dichloronaphthalen-2-yl)methyl]-2H-pyrazolo[4,3-b]pyridine;1-(3,3-difluorobutan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;1-ethyl-3-methyl-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine with MolForge

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Related Compounds

1,4-dichloro-N-[5-[3-[[1-(trifluoromethyl)isoquinolin-6-yl]amino]-1H-pyrazolo[3,4-b]pyrazin-5-yl]-1H-pyrazolo[4,3-b]pyridin-3-yl]isoquinolin-6-amine
CID 137551818
7-(2-chlorophenyl)-N-(1H-indazol-3-yl)-1,6-naphthyridin-5-amine;3-(2-chlorophenyl)-N-(1H-indazol-3-yl)-5,6,7,8-tetrahydroisoquinolin-1-amine;N-(5-fluoro-1H-indazol-3-yl)-3-[2-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydroisoquinolin-1-amine;N-(1H-indazol-3-yl)-3-[2-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydroisoquinolin-1-amine
CID 157212739
CID 157227137
CID 157227137
1-N-(3,3-difluorocyclobutyl)-1-N-methyl-6-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)naphthalene-1,6-diamine;1-N-(3,3-difluorocyclobutyl)-6-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)naphthalene-1,6-diamine;1-N-(3,3-difluorocyclobutyl)-6-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)naphthalene-1,6-diamine;1-N-(3-fluorocyclobutyl)-6-N-(2H-pyrazolo[3,4-b]pyrazin-3-yl)naphthalene-1,6-diamine;1-N-(3-methylcyclobutyl)-6-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)naphthalene-1,6-diamine;1-N-(3-methylcyclobutyl)-6-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)naphthalene-1,6-diamine
CID 157236926
N-[2-(2-chlorophenyl)-5,6-dimethylpyrimidin-4-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine;N-[2-(2-chlorophenyl)-6-methylpyrimidin-4-yl]-5-fluoro-1H-indazol-3-amine;N-[5-ethyl-6-methyl-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]-5-fluoro-1H-indazol-3-amine;N-[6-methyl-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine
CID 157337387
1-bromo-3-propan-2-ylbenzene;1-chloro-3-propan-2-ylbenzene;N,N-dimethyl-2-propan-2-ylpyrimidin-5-amine;1-fluoro-3-propan-2-ylbenzene;methane;1-methyl-4-propan-2-ylbenzimidazole;1-methyl-5-propan-2-ylbenzimidazole;1-methyl-5-propan-2-ylindazole;1-methyl-4-propan-2-ylindole;1-methyl-5-propan-2-ylindole;1-methyl-6-propan-2-ylindole;1-methyl-7-propan-2-ylindole;2-methyl-5-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyrimidine;4-propan-2-yl-1H-benzimidazole;5-propan-2-yl-1H-indazole;5-propan-2-yl-3H-indazole;6-propan-2-yl-1H-indene;7-propan-2-yl-1H-indene;4-propan-2-yl-1H-indole;5-propan-2-yl-1H-indole;6-propan-2-ylpyridin-3-amine;5-propan-2-yl-2-(trifluoromethyl)pyridine;5-propan-2-yl-2-(trifluoromethyl)pyrimidine
CID 157378604
CID 157491628
CID 157491628
5-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine;5-[2-(3-cyclopropylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine;4-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(6-piperazin-1-yl-3-pyridinyl)pyrimidin-2-amine;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine;5-[2-(3-methylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine;5-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]pyrazolo[1,5-a]pyrimidine
CID 157562477
3-(2-amino-3H-benzimidazol-5-yl)-1-[[2-(2-methylphenyl)quinolin-3-yl]methyl]pyrazolo[3,4-d]pyrimidin-4-amine;3-(2-amino-3H-benzimidazol-5-yl)-1-[[2-[2-(trifluoromethyl)phenyl]quinolin-3-yl]methyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-[(2-phenylquinolin-3-yl)methyl]-3-(1H-pyrazol-4-yl)pyrazolo[3,4-d]pyrimidin-4-amine
CID 157619872
2-[2-(8-Chloro-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)ethyl]-3-methylbenzo[e]benzimidazole;3-methyl-2-[2-[5-methyl-8-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethyl]benzo[e]benzimidazole;bis(3-methyl-2-[2-([1,2,4]triazolo[1,5-a]pyridin-2-yl)ethyl]imidazo[4,5-h]quinoline);2-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)ethyl]-[1,2,4]triazolo[5,1-a]isoquinoline;2-[2-([1,2,4]triazolo[1,5-a]pyridin-2-yl)ethyl]-[1,2,4]triazolo[1,5-h][1,7]naphthyridine
CID 157895805
N-[5-(2-chlorophenyl)-1,2,4-triazin-3-yl]-5-fluoro-1H-indazol-3-amine;N-[5-(2-chlorophenyl)-1,2,4-triazin-3-yl]-1H-indazol-3-amine;bis(N-[6-cyclopropyl-3-[2-(trifluoromethyl)phenyl]-1,2,4-triazin-5-yl]-1H-indazol-3-amine)
CID 157921784
1-(cyclohexen-1-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;1-(1,1-difluoro-2-methylpropyl)-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)isoquinolin-6-amine;N-(5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-yl)-1-(trifluoromethyl)isoquinolin-6-amine;N-(6-fluoro-1H-pyrazolo[4,3-b]pyridin-3-yl)-1-(trifluoromethyl)isoquinolin-6-amine
CID 157959578

Frequently Asked Questions

What is the IUPAC name of 3-[(5,8-dichloronaphthalen-2-yl)methyl]-2H-pyrazolo[4,3-b]pyridine;1-(3,3-difluorobutan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;1-ethyl-3-methyl-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine?
The IUPAC name of 3-[(5,8-dichloronaphthalen-2-yl)methyl]-2H-pyrazolo[4,3-b]pyridine;1-(3,3-difluorobutan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;1-ethyl-3-methyl-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine (CID 157274566) is 3-[(5,8-dichloronaphthalen-2-yl)methyl]-2H-pyrazolo[4,3-b]pyridine;1-(3,3-difluorobutan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;1-ethyl-3-methyl-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine.
What is the SMILES notation for 3-[(5,8-dichloronaphthalen-2-yl)methyl]-2H-pyrazolo[4,3-b]pyridine;1-(3,3-difluorobutan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;1-ethyl-3-methyl-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine?
The canonical SMILES for 3-[(5,8-dichloronaphthalen-2-yl)methyl]-2H-pyrazolo[4,3-b]pyridine;1-(3,3-difluorobutan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;1-ethyl-3-methyl-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine is CC(c1nccc2cc(Nc3n[nH]c4cccnc34)ccc12)C(C)(F)F.CCc1nc(C)cc2cc(Nc3n[nH]c4cccnc34)ccc12.Clc1ccc(Cl)c2cc(Cc3[nH]nc4cccnc34)ccc12.FC(F)(F)c1cccc2cc(Nc3[nH]nc4ncccc34)ccc12.FC(F)(F)c1cccc2cc(Nc3[nH]nc4nccnc34)ccc12.FC(F)c1cccc2cc(Nc3[nH]nc4nccnc34)ccc12.FC(F)c1cccc2cc(Nc3n[nH]c4cccnc34)ccc12.
What is the InChIKey of 3-[(5,8-dichloronaphthalen-2-yl)methyl]-2H-pyrazolo[4,3-b]pyridine;1-(3,3-difluorobutan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;1-ethyl-3-methyl-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine?
The InChIKey is AYYCDHCQHFVPEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17F2N5.C18H17N5.C17H11Cl2N3.C17H11F3N4.C17H12F2N4.C16H10F3N5.C16H11F2N5/c1-11(19(2,20)21)16-14-6-5-13(10-12(14)7-9-23-16)24-18-17-15(25-26-18)4-3-8-22-17;1-3-15-14-7-6-13(10-12(14)9-11(2)20-15)21-18-17-16(22-23-18)5-4-8-19-17;18-13-5-6-14(19)12-8-10(3-4-11(12)13)9-16-17-15(21-22-16)2-1-7-20-17;18-17(19,20)14-5-1-3-10-9-11(6-7-12(10)14)22-16-13-4-2-8-21-15(13)23-24-16;18-16(19)13-4-1-3-10-9-11(6-7-12(10)13)21-17-15-14(22-23-17)5-2-8-20-15;17-16(18,19)12-3-1-2-9-8-10(4-5-11(9)12)22-15-13-14(23-24-15)21-7-6-20-13;17-14(18)12-3-1-2-9-8-10(4-5-11(9)12)21-16-13-15(22-23-16)20-7-6-19-13/h3-11H,1-2H3,(H2,24,25,26);4-10H,3H2,1-2H3,(H2,21,22,23);1-8H,9H2,(H,21,22);1-9H,(H2,21,22,23,24);1-9,16H,(H2,21,22,23);1-8H,(H2,21,22,23,24);1-8,14H,(H2,20,21,22,23).
What are the key properties of 3-[(5,8-dichloronaphthalen-2-yl)methyl]-2H-pyrazolo[4,3-b]pyridine;1-(3,3-difluorobutan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;1-ethyl-3-methyl-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine?
3-[(5,8-dichloronaphthalen-2-yl)methyl]-2H-pyrazolo[4,3-b]pyridine;1-(3,3-difluorobutan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;1-ethyl-3-methyl-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine has a molecular weight of 2264.13 g/mol, XLogP of 32.26, 19 rotatable bonds, 13 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(5,8-dichloronaphthalen-2-yl)methyl]-2H-pyrazolo[4,3-b]pyridine;1-(3,3-difluorobutan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;1-ethyl-3-methyl-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine is sourced from PubChem (CID 157274566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).