N-[8-fluoro-5-(furan-2-yl)naphthalen-2-yl]-5H-pyrrolo[3,4-b]pyridin-7-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine;N-(8-fluoro-5-methylnaphthalen-2-yl)-5H-pyrrolo[3,4-b]pyridin-7-amine

C73H54F4N14O — CID 159216685

IUPACN-[8-fluoro-5-(furan-2-yl)naphthalen-2-yl]-5H-pyrrolo[3,4-b]pyridin-7-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine;N-(8-fluoro-5-methylnaphthalen-2-yl)-5H-pyrrolo[3,4-b]pyridin-7-amine
SMILESCc1ccc(F)c2cc(NC3=NCc4cccnc43)ccc12.FCc1cccc2cc(Nc3[nH]nc4ncccc34)ccc12.FCc1cccc2cc(Nc3n[nH]c4cccnc34)ccc12.Fc1ccc(-c2ccco2)c2ccc(NC3=NCc4cccnc43)cc12
InChIInChI=1S/C21H14FN3O.C18H14FN3.2C17H13FN4/c22-18-8-7-16(19-4-2-10-26-19)15-6-5-14(11-17(15)18)25-21-20-13(12-24-21)3-1-9-23-20;1-11-4-7-16(19)15-9-13(5-6-14(11)15)22-18-17-12(10-21-18)3-2-8-20-17;18-10-12-4-1-3-11-9-13(6-7-14(11)12)20-17-16-15(21-22-17)5-2-8-19-16;18-10-12-4-1-3-11-9-13(6-7-14(11)12)20-17-15-5-2-8-19-16(15)21-22-17/h1-11H,12H2,(H,24,25);2-9H,10H2,1H3,(H,21,22);1-9H,10H2,(H2,20,21,22);1-9H,10H2,(H2,19,20,21,22)
InChIKeyKRDVVUKAMCFRIQ-UHFFFAOYSA-N
MW1219.32 g/mol
LogP17.71
Rot. Bonds9

About N-[8-fluoro-5-(furan-2-yl)naphthalen-2-yl]-5H-pyrrolo[3,4-b]pyridin-7-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine;N-(8-fluoro-5-methylnaphthalen-2-yl)-5H-pyrrolo[3,4-b]pyridin-7-amine

N-[8-fluoro-5-(furan-2-yl)naphthalen-2-yl]-5H-pyrrolo[3,4-b]pyridin-7-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine;N-(8-fluoro-5-methylnaphthalen-2-yl)-5H-pyrrolo[3,4-b]pyridin-7-amine (PubChem CID 159216685) has the molecular formula C73H54F4N14O and a molecular weight of 1219.32 g/mol. Its IUPAC name is N-[8-fluoro-5-(furan-2-yl)naphthalen-2-yl]-5H-pyrrolo[3,4-b]pyridin-7-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine;N-(8-fluoro-5-methylnaphthalen-2-yl)-5H-pyrrolo[3,4-b]pyridin-7-amine.

Molecular Properties

Compound NameN-[8-fluoro-5-(furan-2-yl)naphthalen-2-yl]-5H-pyrrolo[3,4-b]pyridin-7-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine;N-(8-fluoro-5-methylnaphthalen-2-yl)-5H-pyrrolo[3,4-b]pyridin-7-amine
PubChem CID159216685
Molecular FormulaC73H54F4N14O
Molecular Weight1219.32 g/mol
Exact Mass1218.45
IUPAC NameN-[8-fluoro-5-(furan-2-yl)naphthalen-2-yl]-5H-pyrrolo[3,4-b]pyridin-7-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine;N-(8-fluoro-5-methylnaphthalen-2-yl)-5H-pyrrolo[3,4-b]pyridin-7-amine
SMILESCc1ccc(F)c2cc(NC3=NCc4cccnc43)ccc12.FCc1cccc2cc(Nc3[nH]nc4ncccc34)ccc12.FCc1cccc2cc(Nc3n[nH]c4cccnc34)ccc12.Fc1ccc(-c2ccco2)c2ccc(NC3=NCc4cccnc43)cc12
InChIInChI=1S/C21H14FN3O.C18H14FN3.2C17H13FN4/c22-18-8-7-16(19-4-2-10-26-19)15-6-5-14(11-17(15)18)25-21-20-13(12-24-21)3-1-9-23-20;1-11-4-7-16(19)15-9-13(5-6-14(11)15)22-18-17-12(10-21-18)3-2-8-20-17;18-10-12-4-1-3-11-9-13(6-7-14(11)12)20-17-16-15(21-22-17)5-2-8-19-16;18-10-12-4-1-3-11-9-13(6-7-14(11)12)20-17-15-5-2-8-19-16(15)21-22-17/h1-11H,12H2,(H,24,25);2-9H,10H2,1H3,(H,21,22);1-9H,10H2,(H2,20,21,22);1-9H,10H2,(H2,19,20,21,22)
InChIKeyKRDVVUKAMCFRIQ-UHFFFAOYSA-N
XLogP17.71
TPSA194.90 Ų
H-Bond Donors6
H-Bond Acceptors13
Rotatable Bonds9
Heavy Atoms92
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001219.32
LogP ≤ 517.71
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1013

Analyze N-[8-fluoro-5-(furan-2-yl)naphthalen-2-yl]-5H-pyrrolo[3,4-b]pyridin-7-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine;N-(8-fluoro-5-methylnaphthalen-2-yl)-5H-pyrrolo[3,4-b]pyridin-7-amine with MolForge

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Related Compounds

2-[5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]pyridin-3-yl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-7-(furan-3-yl)-3H-imidazo[4,5-c]pyridine
CID 136495687
N-[[5-[4-fluoro-3-[4-(furan-3-yl)-1H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]methyl]ethanamine
CID 136945342
1-[5-[4-fluoro-3-[4-(furan-3-yl)-1H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]-N,N-dimethylmethanamine
CID 136945346
5-[4-fluoro-3-[4-(furan-3-yl)-1H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-N-propan-2-ylpyridin-3-amine
CID 136945347
N-[[5-[4-fluoro-3-[4-(furan-3-yl)-1H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]methyl]-1-phenylmethanamine
CID 136945350
4-fluoro-3-[4-(furan-3-yl)-1H-imidazo[4,5-c]pyridin-2-yl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridine
CID 136945362
5-[4-fluoro-3-[4-(furan-3-yl)-1H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-N,N-dimethylpyridin-3-amine
CID 136945372
4-fluoro-3-[7-(furan-3-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-pyrazolo[3,4-c]pyridine
CID 136946993
N-[5-[3-[4-[3-fluoro-5-(2-pyrrolidin-1-ylethoxy)phenyl]-1H-pyrrolo[2,3-c]pyridin-2-yl]-1H-pyrazolo[5,4-b]pyridin-5-yl]-3-pyridinyl]benzamide
CID 137039392
N-[5-[3-[4-[3-[2-(dimethylamino)ethoxy]-5-fluorophenyl]-1H-pyrrolo[2,3-c]pyridin-2-yl]-1H-pyrazolo[5,4-b]pyridin-5-yl]-3-pyridinyl]benzamide
CID 137039841
N-[5-[3-[4-[3-[2-(dimethylamino)ethoxy]-5-fluorophenyl]-1H-indol-2-yl]-1H-pyrazolo[5,4-b]pyridin-5-yl]-3-pyridinyl]benzamide
CID 137040779
N-[5-[3-[4-[3-fluoro-5-(2-pyrrolidin-1-ylethoxy)phenyl]-1H-indol-2-yl]-1H-pyrazolo[5,4-b]pyridin-5-yl]-3-pyridinyl]benzamide
CID 137041443

Frequently Asked Questions

What is the IUPAC name of N-[8-fluoro-5-(furan-2-yl)naphthalen-2-yl]-5H-pyrrolo[3,4-b]pyridin-7-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine;N-(8-fluoro-5-methylnaphthalen-2-yl)-5H-pyrrolo[3,4-b]pyridin-7-amine?
The IUPAC name of N-[8-fluoro-5-(furan-2-yl)naphthalen-2-yl]-5H-pyrrolo[3,4-b]pyridin-7-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine;N-(8-fluoro-5-methylnaphthalen-2-yl)-5H-pyrrolo[3,4-b]pyridin-7-amine (CID 159216685) is N-[8-fluoro-5-(furan-2-yl)naphthalen-2-yl]-5H-pyrrolo[3,4-b]pyridin-7-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine;N-(8-fluoro-5-methylnaphthalen-2-yl)-5H-pyrrolo[3,4-b]pyridin-7-amine.
What is the SMILES notation for N-[8-fluoro-5-(furan-2-yl)naphthalen-2-yl]-5H-pyrrolo[3,4-b]pyridin-7-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine;N-(8-fluoro-5-methylnaphthalen-2-yl)-5H-pyrrolo[3,4-b]pyridin-7-amine?
The canonical SMILES for N-[8-fluoro-5-(furan-2-yl)naphthalen-2-yl]-5H-pyrrolo[3,4-b]pyridin-7-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine;N-(8-fluoro-5-methylnaphthalen-2-yl)-5H-pyrrolo[3,4-b]pyridin-7-amine is Cc1ccc(F)c2cc(NC3=NCc4cccnc43)ccc12.FCc1cccc2cc(Nc3[nH]nc4ncccc34)ccc12.FCc1cccc2cc(Nc3n[nH]c4cccnc34)ccc12.Fc1ccc(-c2ccco2)c2ccc(NC3=NCc4cccnc43)cc12.
What is the InChIKey of N-[8-fluoro-5-(furan-2-yl)naphthalen-2-yl]-5H-pyrrolo[3,4-b]pyridin-7-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine;N-(8-fluoro-5-methylnaphthalen-2-yl)-5H-pyrrolo[3,4-b]pyridin-7-amine?
The InChIKey is KRDVVUKAMCFRIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14FN3O.C18H14FN3.2C17H13FN4/c22-18-8-7-16(19-4-2-10-26-19)15-6-5-14(11-17(15)18)25-21-20-13(12-24-21)3-1-9-23-20;1-11-4-7-16(19)15-9-13(5-6-14(11)15)22-18-17-12(10-21-18)3-2-8-20-17;18-10-12-4-1-3-11-9-13(6-7-14(11)12)20-17-16-15(21-22-17)5-2-8-19-16;18-10-12-4-1-3-11-9-13(6-7-14(11)12)20-17-15-5-2-8-19-16(15)21-22-17/h1-11H,12H2,(H,24,25);2-9H,10H2,1H3,(H,21,22);1-9H,10H2,(H2,20,21,22);1-9H,10H2,(H2,19,20,21,22).
What are the key properties of N-[8-fluoro-5-(furan-2-yl)naphthalen-2-yl]-5H-pyrrolo[3,4-b]pyridin-7-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine;N-(8-fluoro-5-methylnaphthalen-2-yl)-5H-pyrrolo[3,4-b]pyridin-7-amine?
N-[8-fluoro-5-(furan-2-yl)naphthalen-2-yl]-5H-pyrrolo[3,4-b]pyridin-7-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine;N-(8-fluoro-5-methylnaphthalen-2-yl)-5H-pyrrolo[3,4-b]pyridin-7-amine has a molecular weight of 1219.32 g/mol, XLogP of 17.71, 9 rotatable bonds, 6 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for N-[8-fluoro-5-(furan-2-yl)naphthalen-2-yl]-5H-pyrrolo[3,4-b]pyridin-7-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(fluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine;N-(8-fluoro-5-methylnaphthalen-2-yl)-5H-pyrrolo[3,4-b]pyridin-7-amine is sourced from PubChem (CID 159216685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).