2-[5-(5-fluoro-3-pyridinyl)-7-[2-(1H-indol-3-yl)ethylamino]pyrazolo[1,5-a]pyrimidin-3-yl]propan-2-ol;5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3,6-dimethylpyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(7-methoxy-1H-indol-3-yl)ethyl]-3-methylpyrazolo[1,5-a]pyrimidin-7-amine;3-[2-[[5-(5-fluoro-3-pyridinyl)-3-methylpyrazolo[1,5-a]pyrimidin-7-yl]amino]ethyl]-1H-indol-7-ol

C92H84F4N24O3 — CID 159949200

IUPAC2-[5-(5-fluoro-3-pyridinyl)-7-[2-(1H-indol-3-yl)ethylamino]pyrazolo[1,5-a]pyrimidin-3-yl]propan-2-ol;5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3,6-dimethylpyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(7-methoxy-1H-indol-3-yl)ethyl]-3-methylpyrazolo[1,5-a]pyrimidin-7-amine;3-[2-[[5-(5-fluoro-3-pyridinyl)-3-methylpyrazolo[1,5-a]pyrimidin-7-yl]amino]ethyl]-1H-indol-7-ol
SMILESCC(C)(O)c1cnn2c(NCCc3c[nH]c4ccccc34)cc(-c3cncc(F)c3)nc12.COc1cccc2c(CCNc3cc(-c4cncc(F)c4)nc4c(C)cnn34)c[nH]c12.Cc1c(-c2cncc(F)c2)nc2c(C)cnn2c1NCCc1c[nH]c2ccccc12.Cc1cnn2c(NCCc3c[nH]c4c(O)cccc34)cc(-c3cncc(F)c3)nc12
InChIInChI=1S/C24H23FN6O.C23H21FN6O.C23H21FN6.C22H19FN6O/c1-24(2,32)19-14-29-31-22(10-21(30-23(19)31)16-9-17(25)13-26-11-16)27-8-7-15-12-28-20-6-4-3-5-18(15)20;1-14-10-28-30-21(9-19(29-23(14)30)16-8-17(24)13-25-11-16)26-7-6-15-12-27-22-18(15)4-3-5-20(22)31-2;1-14-10-28-30-22(14)29-21(17-9-18(24)13-25-11-17)15(2)23(30)26-8-7-16-12-27-20-6-4-3-5-19(16)20;1-13-9-27-29-20(8-18(28-22(13)29)15-7-16(23)12-24-10-15)25-6-5-14-11-26-21-17(14)3-2-4-19(21)30/h3-6,9-14,27-28,32H,7-8H2,1-2H3;3-5,8-13,26-27H,6-7H2,1-2H3;3-6,9-13,26-27H,7-8H2,1-2H3;2-4,7-12,25-26,30H,5-6H2,1H3
InChIKeyOBWRDNZPCFBDQL-UHFFFAOYSA-N
MW1649.84 g/mol
LogP17.44
Rot. Bonds22

About 2-[5-(5-fluoro-3-pyridinyl)-7-[2-(1H-indol-3-yl)ethylamino]pyrazolo[1,5-a]pyrimidin-3-yl]propan-2-ol;5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3,6-dimethylpyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(7-methoxy-1H-indol-3-yl)ethyl]-3-methylpyrazolo[1,5-a]pyrimidin-7-amine;3-[2-[[5-(5-fluoro-3-pyridinyl)-3-methylpyrazolo[1,5-a]pyrimidin-7-yl]amino]ethyl]-1H-indol-7-ol

2-[5-(5-fluoro-3-pyridinyl)-7-[2-(1H-indol-3-yl)ethylamino]pyrazolo[1,5-a]pyrimidin-3-yl]propan-2-ol;5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3,6-dimethylpyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(7-methoxy-1H-indol-3-yl)ethyl]-3-methylpyrazolo[1,5-a]pyrimidin-7-amine;3-[2-[[5-(5-fluoro-3-pyridinyl)-3-methylpyrazolo[1,5-a]pyrimidin-7-yl]amino]ethyl]-1H-indol-7-ol (PubChem CID 159949200) has the molecular formula C92H84F4N24O3 and a molecular weight of 1649.84 g/mol. Its IUPAC name is 2-[5-(5-fluoro-3-pyridinyl)-7-[2-(1H-indol-3-yl)ethylamino]pyrazolo[1,5-a]pyrimidin-3-yl]propan-2-ol;5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3,6-dimethylpyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(7-methoxy-1H-indol-3-yl)ethyl]-3-methylpyrazolo[1,5-a]pyrimidin-7-amine;3-[2-[[5-(5-fluoro-3-pyridinyl)-3-methylpyrazolo[1,5-a]pyrimidin-7-yl]amino]ethyl]-1H-indol-7-ol.

Molecular Properties

Compound Name2-[5-(5-fluoro-3-pyridinyl)-7-[2-(1H-indol-3-yl)ethylamino]pyrazolo[1,5-a]pyrimidin-3-yl]propan-2-ol;5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3,6-dimethylpyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(7-methoxy-1H-indol-3-yl)ethyl]-3-methylpyrazolo[1,5-a]pyrimidin-7-amine;3-[2-[[5-(5-fluoro-3-pyridinyl)-3-methylpyrazolo[1,5-a]pyrimidin-7-yl]amino]ethyl]-1H-indol-7-ol
PubChem CID159949200
Molecular FormulaC92H84F4N24O3
Molecular Weight1649.84 g/mol
Exact Mass1648.71
IUPAC Name2-[5-(5-fluoro-3-pyridinyl)-7-[2-(1H-indol-3-yl)ethylamino]pyrazolo[1,5-a]pyrimidin-3-yl]propan-2-ol;5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3,6-dimethylpyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(7-methoxy-1H-indol-3-yl)ethyl]-3-methylpyrazolo[1,5-a]pyrimidin-7-amine;3-[2-[[5-(5-fluoro-3-pyridinyl)-3-methylpyrazolo[1,5-a]pyrimidin-7-yl]amino]ethyl]-1H-indol-7-ol
SMILESCC(C)(O)c1cnn2c(NCCc3c[nH]c4ccccc34)cc(-c3cncc(F)c3)nc12.COc1cccc2c(CCNc3cc(-c4cncc(F)c4)nc4c(C)cnn34)c[nH]c12.Cc1c(-c2cncc(F)c2)nc2c(C)cnn2c1NCCc1c[nH]c2ccccc12.Cc1cnn2c(NCCc3c[nH]c4c(O)cccc34)cc(-c3cncc(F)c3)nc12
InChIInChI=1S/C24H23FN6O.C23H21FN6O.C23H21FN6.C22H19FN6O/c1-24(2,32)19-14-29-31-22(10-21(30-23(19)31)16-9-17(25)13-26-11-16)27-8-7-15-12-28-20-6-4-3-5-18(15)20;1-14-10-28-30-21(9-19(29-23(14)30)16-8-17(24)13-25-11-16)26-7-6-15-12-27-22-18(15)4-3-5-20(22)31-2;1-14-10-28-30-22(14)29-21(17-9-18(24)13-25-11-17)15(2)23(30)26-8-7-16-12-27-20-6-4-3-5-19(16)20;1-13-9-27-29-20(8-18(28-22(13)29)15-7-16(23)12-24-10-15)25-6-5-14-11-26-21-17(14)3-2-4-19(21)30/h3-6,9-14,27-28,32H,7-8H2,1-2H3;3-5,8-13,26-27H,6-7H2,1-2H3;3-6,9-13,26-27H,7-8H2,1-2H3;2-4,7-12,25-26,30H,5-6H2,1H3
InChIKeyOBWRDNZPCFBDQL-UHFFFAOYSA-N
XLogP17.44
TPSA333.29 Ų
H-Bond Donors10
H-Bond Acceptors23
Rotatable Bonds22
Heavy Atoms123
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001649.84
LogP ≤ 517.44
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1023

Analyze 2-[5-(5-fluoro-3-pyridinyl)-7-[2-(1H-indol-3-yl)ethylamino]pyrazolo[1,5-a]pyrimidin-3-yl]propan-2-ol;5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3,6-dimethylpyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(7-methoxy-1H-indol-3-yl)ethyl]-3-methylpyrazolo[1,5-a]pyrimidin-7-amine;3-[2-[[5-(5-fluoro-3-pyridinyl)-3-methylpyrazolo[1,5-a]pyrimidin-7-yl]amino]ethyl]-1H-indol-7-ol with MolForge

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Related Compounds

2,2-difluoro-1-(4-fluorophenyl)-1-[2-[4-[6-[2-[4-[4-[5-[1-(4-fluorophenyl)-1-hydroxyethyl]pyrimidin-2-yl]piperazin-1-yl]-6-[4-[4-[4-[5-[1-(4-fluorophenyl)-1-hydroxyethyl]pyrimidin-2-yl]piperazin-1-yl]-6-(4-methoxyphenyl)pyrrolo[2,1-f][1,2,4]triazin-3-ium-3-yl]-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-2-yl]-1H-pyrazol-2-ium-4-yl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]piperazin-1-yl]pyrimidin-5-yl]ethanol
CID 123709459
2-[4-amino-1-[2-[4-[[2-[4-amino-1-[1-[[2-[4-amino-1-[1-[[2-(4-amino-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-yl)-6-fluoro-1H-indol-5-yl]oxy]ethyl]pyrazolo[3,4-d]pyrimidin-3-yl]-4-fluoro-1H-indol-5-yl]oxy]propan-2-yl]pyrazolo[4,3-c]pyridin-3-yl]-1H-indol-5-yl]oxy]-2-methylimidazol-1-yl]ethyl]pyrazolo[3,4-d]pyrimidin-3-yl]-1H-indol-5-ol
CID 123808231
5-Amino-2-[2-(5,7-dihydropyrrolo[3,4-b]pyridin-6-yl)ethyl]-9-[[2-[2-(5,7-dihydropyrrolo[3,4-b]pyridin-6-yl)ethyl]-7-(fluoromethoxy)-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]amino]-[1,2,4]triazolo[1,5-c]quinazolin-7-ol
CID 130219619
3-(methoxymethyl)-4-[6-[5-(6-methyl-2-pyridinyl)-2-[[4-[[6-[5-(6-methyl-2-pyridinyl)-2-[[2-(trifluoromethoxy)anilino]methyl]-1H-imidazol-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methoxymethyl]anilino]methyl]-1H-imidazol-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]aniline
CID 132035434
3-[2-[[5-(5-fluoro-3-pyridinyl)-3-(hydroxymethyl)pyrazolo[1,5-a]pyrimidin-7-yl]amino]ethyl]-1H-indol-7-ol
CID 135363443
5-(5-fluoro-3-pyridinyl)-N-[2-(7-methoxy-1H-indol-3-yl)ethyl]-3-methylpyrazolo[1,5-a]pyrimidin-7-amine
CID 135376300
3-[2-[[5-(5-fluoro-3-pyridinyl)-3-methylpyrazolo[1,5-a]pyrimidin-7-yl]amino]ethyl]-1H-indol-7-ol
CID 135376590
5-[1-[1-[2-[3-fluoro-5-[2-(5-pyridin-4-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-1H-benzimidazol-4-yl]phenoxy]ethyl]pyrrolidin-3-yl]-3-[4-[3-fluoro-5-(2-pyrrolidin-1-ylethoxy)phenyl]-1H-benzimidazol-2-yl]pyrazolo[4,3-b]pyridin-5-yl]pyridin-3-ol
CID 137087338
3-fluoro-5-[2-[5-(5-methoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-3-yl]-1H-pyrrolo[3,2-c]pyridin-4-yl]phenol
CID 137145271
5-[3-[4-(3-fluoro-5-methoxyphenyl)-1H-pyrrolo[3,2-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]pyridin-3-ol
CID 137311015
(3S)-N-[2-(5-fluoro-3-pyridinyl)-8-propan-2-ylpyrazolo[1,5-a][1,3,5]triazin-4-yl]-8-methoxy-2,3,4,9-tetrahydro-1H-carbazol-3-amine
CID 156784360
(3R)-N-[2-(5-fluoro-3-pyridinyl)-8-propan-2-ylpyrazolo[1,5-a][1,3,5]triazin-4-yl]-8-methoxy-2,3,4,9-tetrahydro-1H-carbazol-3-amine
CID 156784483

Frequently Asked Questions

What is the IUPAC name of 2-[5-(5-fluoro-3-pyridinyl)-7-[2-(1H-indol-3-yl)ethylamino]pyrazolo[1,5-a]pyrimidin-3-yl]propan-2-ol;5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3,6-dimethylpyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(7-methoxy-1H-indol-3-yl)ethyl]-3-methylpyrazolo[1,5-a]pyrimidin-7-amine;3-[2-[[5-(5-fluoro-3-pyridinyl)-3-methylpyrazolo[1,5-a]pyrimidin-7-yl]amino]ethyl]-1H-indol-7-ol?
The IUPAC name of 2-[5-(5-fluoro-3-pyridinyl)-7-[2-(1H-indol-3-yl)ethylamino]pyrazolo[1,5-a]pyrimidin-3-yl]propan-2-ol;5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3,6-dimethylpyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(7-methoxy-1H-indol-3-yl)ethyl]-3-methylpyrazolo[1,5-a]pyrimidin-7-amine;3-[2-[[5-(5-fluoro-3-pyridinyl)-3-methylpyrazolo[1,5-a]pyrimidin-7-yl]amino]ethyl]-1H-indol-7-ol (CID 159949200) is 2-[5-(5-fluoro-3-pyridinyl)-7-[2-(1H-indol-3-yl)ethylamino]pyrazolo[1,5-a]pyrimidin-3-yl]propan-2-ol;5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3,6-dimethylpyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(7-methoxy-1H-indol-3-yl)ethyl]-3-methylpyrazolo[1,5-a]pyrimidin-7-amine;3-[2-[[5-(5-fluoro-3-pyridinyl)-3-methylpyrazolo[1,5-a]pyrimidin-7-yl]amino]ethyl]-1H-indol-7-ol.
What is the SMILES notation for 2-[5-(5-fluoro-3-pyridinyl)-7-[2-(1H-indol-3-yl)ethylamino]pyrazolo[1,5-a]pyrimidin-3-yl]propan-2-ol;5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3,6-dimethylpyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(7-methoxy-1H-indol-3-yl)ethyl]-3-methylpyrazolo[1,5-a]pyrimidin-7-amine;3-[2-[[5-(5-fluoro-3-pyridinyl)-3-methylpyrazolo[1,5-a]pyrimidin-7-yl]amino]ethyl]-1H-indol-7-ol?
The canonical SMILES for 2-[5-(5-fluoro-3-pyridinyl)-7-[2-(1H-indol-3-yl)ethylamino]pyrazolo[1,5-a]pyrimidin-3-yl]propan-2-ol;5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3,6-dimethylpyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(7-methoxy-1H-indol-3-yl)ethyl]-3-methylpyrazolo[1,5-a]pyrimidin-7-amine;3-[2-[[5-(5-fluoro-3-pyridinyl)-3-methylpyrazolo[1,5-a]pyrimidin-7-yl]amino]ethyl]-1H-indol-7-ol is CC(C)(O)c1cnn2c(NCCc3c[nH]c4ccccc34)cc(-c3cncc(F)c3)nc12.COc1cccc2c(CCNc3cc(-c4cncc(F)c4)nc4c(C)cnn34)c[nH]c12.Cc1c(-c2cncc(F)c2)nc2c(C)cnn2c1NCCc1c[nH]c2ccccc12.Cc1cnn2c(NCCc3c[nH]c4c(O)cccc34)cc(-c3cncc(F)c3)nc12.
What is the InChIKey of 2-[5-(5-fluoro-3-pyridinyl)-7-[2-(1H-indol-3-yl)ethylamino]pyrazolo[1,5-a]pyrimidin-3-yl]propan-2-ol;5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3,6-dimethylpyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(7-methoxy-1H-indol-3-yl)ethyl]-3-methylpyrazolo[1,5-a]pyrimidin-7-amine;3-[2-[[5-(5-fluoro-3-pyridinyl)-3-methylpyrazolo[1,5-a]pyrimidin-7-yl]amino]ethyl]-1H-indol-7-ol?
The InChIKey is OBWRDNZPCFBDQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23FN6O.C23H21FN6O.C23H21FN6.C22H19FN6O/c1-24(2,32)19-14-29-31-22(10-21(30-23(19)31)16-9-17(25)13-26-11-16)27-8-7-15-12-28-20-6-4-3-5-18(15)20;1-14-10-28-30-21(9-19(29-23(14)30)16-8-17(24)13-25-11-16)26-7-6-15-12-27-22-18(15)4-3-5-20(22)31-2;1-14-10-28-30-22(14)29-21(17-9-18(24)13-25-11-17)15(2)23(30)26-8-7-16-12-27-20-6-4-3-5-19(16)20;1-13-9-27-29-20(8-18(28-22(13)29)15-7-16(23)12-24-10-15)25-6-5-14-11-26-21-17(14)3-2-4-19(21)30/h3-6,9-14,27-28,32H,7-8H2,1-2H3;3-5,8-13,26-27H,6-7H2,1-2H3;3-6,9-13,26-27H,7-8H2,1-2H3;2-4,7-12,25-26,30H,5-6H2,1H3.
What are the key properties of 2-[5-(5-fluoro-3-pyridinyl)-7-[2-(1H-indol-3-yl)ethylamino]pyrazolo[1,5-a]pyrimidin-3-yl]propan-2-ol;5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3,6-dimethylpyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(7-methoxy-1H-indol-3-yl)ethyl]-3-methylpyrazolo[1,5-a]pyrimidin-7-amine;3-[2-[[5-(5-fluoro-3-pyridinyl)-3-methylpyrazolo[1,5-a]pyrimidin-7-yl]amino]ethyl]-1H-indol-7-ol?
2-[5-(5-fluoro-3-pyridinyl)-7-[2-(1H-indol-3-yl)ethylamino]pyrazolo[1,5-a]pyrimidin-3-yl]propan-2-ol;5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3,6-dimethylpyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(7-methoxy-1H-indol-3-yl)ethyl]-3-methylpyrazolo[1,5-a]pyrimidin-7-amine;3-[2-[[5-(5-fluoro-3-pyridinyl)-3-methylpyrazolo[1,5-a]pyrimidin-7-yl]amino]ethyl]-1H-indol-7-ol has a molecular weight of 1649.84 g/mol, XLogP of 17.44, 22 rotatable bonds, 10 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(5-fluoro-3-pyridinyl)-7-[2-(1H-indol-3-yl)ethylamino]pyrazolo[1,5-a]pyrimidin-3-yl]propan-2-ol;5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3,6-dimethylpyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(7-methoxy-1H-indol-3-yl)ethyl]-3-methylpyrazolo[1,5-a]pyrimidin-7-amine;3-[2-[[5-(5-fluoro-3-pyridinyl)-3-methylpyrazolo[1,5-a]pyrimidin-7-yl]amino]ethyl]-1H-indol-7-ol is sourced from PubChem (CID 159949200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).