N-(5-chloro-8-fluoronaphthalen-2-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine;1-(1,1-difluoroethyl)-N-(2H-pyrazolo[3,4-b]pyrazin-3-yl)isoquinolin-6-amine;1-(2,5-dimethylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;4-fluoro-6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)naphthalen-1-ol;1-(2-methylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-1H-indazol-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine

C122H88ClF10N35O — CID 162116092

IUPACN-(5-chloro-8-fluoronaphthalen-2-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine;1-(1,1-difluoroethyl)-N-(2H-pyrazolo[3,4-b]pyrazin-3-yl)isoquinolin-6-amine;1-(2,5-dimethylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;4-fluoro-6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)naphthalen-1-ol;1-(2-methylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-1H-indazol-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine
SMILESCC(F)(F)c1nccc2cc(Nc3[nH]nc4nccnc34)ccc12.Cc1cc(-c2nccc3cc(Nc4n[nH]c5cccnc45)ccc23)n(C)n1.Cn1nccc1-c1nccc2cc(Nc3n[nH]c4cccnc34)ccc12.FC(F)(F)c1cccc2cc(Nc3[nH]nc4ncccc34)ccc12.FC(F)(F)c1cccc2cc(Nc3n[nH]c4ccccc34)ccc12.Fc1ccc(Cl)c2ccc(Nc3n[nH]c4cccnc34)cc12.Oc1ccc(F)c2cc(Nc3n[nH]c4cccnc34)ccc12
InChIInChI=1S/C20H17N7.C19H15N7.C18H12F3N3.C17H11F3N4.C16H10ClFN4.C16H12F2N6.C16H11FN4O/c1-12-10-17(27(2)26-12)18-15-6-5-14(11-13(15)7-9-22-18)23-20-19-16(24-25-20)4-3-8-21-19;1-26-16(7-10-22-26)17-14-5-4-13(11-12(14)6-9-21-17)23-19-18-15(24-25-19)3-2-8-20-18;19-18(20,21)15-6-3-4-11-10-12(8-9-13(11)15)22-17-14-5-1-2-7-16(14)23-24-17;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;17-12-5-6-13(18)11-8-9(3-4-10(11)12)20-16-15-14(21-22-16)2-1-7-19-15;1-16(17,18)13-11-3-2-10(8-9(11)4-5-20-13)22-15-12-14(23-24-15)21-7-6-19-12;17-12-5-6-14(22)10-4-3-9(8-11(10)12)19-16-15-13(20-21-16)2-1-7-18-15/h3-11H,1-2H3,(H2,23,24,25);2-11H,1H3,(H2,23,24,25);1-10H,(H2,22,23,24);1-9H,(H2,21,22,23,24);1-8H,(H2,20,21,22);2-8H,1H3,(H2,21,22,23,24);1-8,22H,(H2,19,20,21)
InChIKeyZGTZKUQLMTULJT-UHFFFAOYSA-N
MW2285.72 g/mol
LogP30.06
Rot. Bonds17

About N-(5-chloro-8-fluoronaphthalen-2-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine;1-(1,1-difluoroethyl)-N-(2H-pyrazolo[3,4-b]pyrazin-3-yl)isoquinolin-6-amine;1-(2,5-dimethylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;4-fluoro-6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)naphthalen-1-ol;1-(2-methylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-1H-indazol-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine

N-(5-chloro-8-fluoronaphthalen-2-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine;1-(1,1-difluoroethyl)-N-(2H-pyrazolo[3,4-b]pyrazin-3-yl)isoquinolin-6-amine;1-(2,5-dimethylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;4-fluoro-6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)naphthalen-1-ol;1-(2-methylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-1H-indazol-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine (PubChem CID 162116092) has the molecular formula C122H88ClF10N35O and a molecular weight of 2285.72 g/mol. Its IUPAC name is N-(5-chloro-8-fluoronaphthalen-2-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine;1-(1,1-difluoroethyl)-N-(2H-pyrazolo[3,4-b]pyrazin-3-yl)isoquinolin-6-amine;1-(2,5-dimethylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;4-fluoro-6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)naphthalen-1-ol;1-(2-methylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-1H-indazol-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine.

Molecular Properties

Compound NameN-(5-chloro-8-fluoronaphthalen-2-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine;1-(1,1-difluoroethyl)-N-(2H-pyrazolo[3,4-b]pyrazin-3-yl)isoquinolin-6-amine;1-(2,5-dimethylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;4-fluoro-6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)naphthalen-1-ol;1-(2-methylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-1H-indazol-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine
PubChem CID162116092
Molecular FormulaC122H88ClF10N35O
Molecular Weight2285.72 g/mol
Exact Mass2283.74
IUPAC NameN-(5-chloro-8-fluoronaphthalen-2-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine;1-(1,1-difluoroethyl)-N-(2H-pyrazolo[3,4-b]pyrazin-3-yl)isoquinolin-6-amine;1-(2,5-dimethylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;4-fluoro-6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)naphthalen-1-ol;1-(2-methylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-1H-indazol-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine
SMILESCC(F)(F)c1nccc2cc(Nc3[nH]nc4nccnc34)ccc12.Cc1cc(-c2nccc3cc(Nc4n[nH]c5cccnc45)ccc23)n(C)n1.Cn1nccc1-c1nccc2cc(Nc3n[nH]c4cccnc34)ccc12.FC(F)(F)c1cccc2cc(Nc3[nH]nc4ncccc34)ccc12.FC(F)(F)c1cccc2cc(Nc3n[nH]c4ccccc34)ccc12.Fc1ccc(Cl)c2ccc(Nc3n[nH]c4cccnc34)cc12.Oc1ccc(F)c2cc(Nc3n[nH]c4cccnc34)ccc12
InChIInChI=1S/C20H17N7.C19H15N7.C18H12F3N3.C17H11F3N4.C16H10ClFN4.C16H12F2N6.C16H11FN4O/c1-12-10-17(27(2)26-12)18-15-6-5-14(11-13(15)7-9-22-18)23-20-19-16(24-25-20)4-3-8-21-19;1-26-16(7-10-22-26)17-14-5-4-13(11-12(14)6-9-21-17)23-19-18-15(24-25-19)3-2-8-20-18;19-18(20,21)15-6-3-4-11-10-12(8-9-13(11)15)22-17-14-5-1-2-7-16(14)23-24-17;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;17-12-5-6-13(18)11-8-9(3-4-10(11)12)20-16-15-14(21-22-16)2-1-7-19-15;1-16(17,18)13-11-3-2-10(8-9(11)4-5-20-13)22-15-12-14(23-24-15)21-7-6-19-12;17-12-5-6-14(22)10-4-3-9(8-11(10)12)19-16-15-13(20-21-16)2-1-7-18-15/h3-11H,1-2H3,(H2,23,24,25);2-11H,1H3,(H2,23,24,25);1-10H,(H2,22,23,24);1-9H,(H2,21,22,23,24);1-8H,(H2,20,21,22);2-8H,1H3,(H2,21,22,23,24);1-8,22H,(H2,19,20,21)
InChIKeyZGTZKUQLMTULJT-UHFFFAOYSA-N
XLogP30.06
TPSA469.74 Ų
H-Bond Donors15
H-Bond Acceptors29
Rotatable Bonds17
Heavy Atoms169
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002285.72
LogP ≤ 530.06
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 1029

Analyze N-(5-chloro-8-fluoronaphthalen-2-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine;1-(1,1-difluoroethyl)-N-(2H-pyrazolo[3,4-b]pyrazin-3-yl)isoquinolin-6-amine;1-(2,5-dimethylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;4-fluoro-6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)naphthalen-1-ol;1-(2-methylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-1H-indazol-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-8-fluoronaphthalen-2-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine;1-(1,1-difluoroethyl)-N-(2H-pyrazolo[3,4-b]pyrazin-3-yl)isoquinolin-6-amine;1-(2,5-dimethylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;4-fluoro-6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)naphthalen-1-ol;1-(2-methylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-1H-indazol-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine?
The IUPAC name of N-(5-chloro-8-fluoronaphthalen-2-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine;1-(1,1-difluoroethyl)-N-(2H-pyrazolo[3,4-b]pyrazin-3-yl)isoquinolin-6-amine;1-(2,5-dimethylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;4-fluoro-6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)naphthalen-1-ol;1-(2-methylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-1H-indazol-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine (CID 162116092) is N-(5-chloro-8-fluoronaphthalen-2-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine;1-(1,1-difluoroethyl)-N-(2H-pyrazolo[3,4-b]pyrazin-3-yl)isoquinolin-6-amine;1-(2,5-dimethylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;4-fluoro-6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)naphthalen-1-ol;1-(2-methylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-1H-indazol-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine.
What is the SMILES notation for N-(5-chloro-8-fluoronaphthalen-2-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine;1-(1,1-difluoroethyl)-N-(2H-pyrazolo[3,4-b]pyrazin-3-yl)isoquinolin-6-amine;1-(2,5-dimethylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;4-fluoro-6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)naphthalen-1-ol;1-(2-methylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-1H-indazol-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine?
The canonical SMILES for N-(5-chloro-8-fluoronaphthalen-2-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine;1-(1,1-difluoroethyl)-N-(2H-pyrazolo[3,4-b]pyrazin-3-yl)isoquinolin-6-amine;1-(2,5-dimethylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;4-fluoro-6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)naphthalen-1-ol;1-(2-methylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-1H-indazol-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine is CC(F)(F)c1nccc2cc(Nc3[nH]nc4nccnc34)ccc12.Cc1cc(-c2nccc3cc(Nc4n[nH]c5cccnc45)ccc23)n(C)n1.Cn1nccc1-c1nccc2cc(Nc3n[nH]c4cccnc34)ccc12.FC(F)(F)c1cccc2cc(Nc3[nH]nc4ncccc34)ccc12.FC(F)(F)c1cccc2cc(Nc3n[nH]c4ccccc34)ccc12.Fc1ccc(Cl)c2ccc(Nc3n[nH]c4cccnc34)cc12.Oc1ccc(F)c2cc(Nc3n[nH]c4cccnc34)ccc12.
What is the InChIKey of N-(5-chloro-8-fluoronaphthalen-2-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine;1-(1,1-difluoroethyl)-N-(2H-pyrazolo[3,4-b]pyrazin-3-yl)isoquinolin-6-amine;1-(2,5-dimethylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;4-fluoro-6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)naphthalen-1-ol;1-(2-methylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-1H-indazol-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine?
The InChIKey is ZGTZKUQLMTULJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N7.C19H15N7.C18H12F3N3.C17H11F3N4.C16H10ClFN4.C16H12F2N6.C16H11FN4O/c1-12-10-17(27(2)26-12)18-15-6-5-14(11-13(15)7-9-22-18)23-20-19-16(24-25-20)4-3-8-21-19;1-26-16(7-10-22-26)17-14-5-4-13(11-12(14)6-9-21-17)23-19-18-15(24-25-19)3-2-8-20-18;19-18(20,21)15-6-3-4-11-10-12(8-9-13(11)15)22-17-14-5-1-2-7-16(14)23-24-17;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;17-12-5-6-13(18)11-8-9(3-4-10(11)12)20-16-15-14(21-22-16)2-1-7-19-15;1-16(17,18)13-11-3-2-10(8-9(11)4-5-20-13)22-15-12-14(23-24-15)21-7-6-19-12;17-12-5-6-14(22)10-4-3-9(8-11(10)12)19-16-15-13(20-21-16)2-1-7-18-15/h3-11H,1-2H3,(H2,23,24,25);2-11H,1H3,(H2,23,24,25);1-10H,(H2,22,23,24);1-9H,(H2,21,22,23,24);1-8H,(H2,20,21,22);2-8H,1H3,(H2,21,22,23,24);1-8,22H,(H2,19,20,21).
What are the key properties of N-(5-chloro-8-fluoronaphthalen-2-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine;1-(1,1-difluoroethyl)-N-(2H-pyrazolo[3,4-b]pyrazin-3-yl)isoquinolin-6-amine;1-(2,5-dimethylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;4-fluoro-6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)naphthalen-1-ol;1-(2-methylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-1H-indazol-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine?
N-(5-chloro-8-fluoronaphthalen-2-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine;1-(1,1-difluoroethyl)-N-(2H-pyrazolo[3,4-b]pyrazin-3-yl)isoquinolin-6-amine;1-(2,5-dimethylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;4-fluoro-6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)naphthalen-1-ol;1-(2-methylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-1H-indazol-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine has a molecular weight of 2285.72 g/mol, XLogP of 30.06, 17 rotatable bonds, 15 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-8-fluoronaphthalen-2-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine;1-(1,1-difluoroethyl)-N-(2H-pyrazolo[3,4-b]pyrazin-3-yl)isoquinolin-6-amine;1-(2,5-dimethylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;4-fluoro-6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)naphthalen-1-ol;1-(2-methylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-1H-indazol-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine is sourced from PubChem (CID 162116092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).