5-fluoro-2-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenol;5-(2-methoxyphenyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxypyrimidin-5-yl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-[2-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine

C101H108F4N22O3 — CID 161035082

IUPAC5-fluoro-2-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenol;5-(2-methoxyphenyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxypyrimidin-5-yl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-[2-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCOc1ccccc1-c1cccc2nc(Nc3ccc(CCCN4CCCC4)cc3)nn12.COc1ncc(-c2cccc3nc(Nc4ccc(CCCN5CCCC5)cc4)nn23)cn1.FC(F)(F)c1ccccc1-c1cccc2nc(Nc3ccc(CCCN4CCCC4)cc3)nn12.Oc1cc(F)ccc1-c1cccc2nc(Nc3ccc(CCCN4CCCC4)cc3)nn12
InChIInChI=1S/C26H26F3N5.C26H29N5O.C25H26FN5O.C24H27N7O/c27-26(28,29)22-9-2-1-8-21(22)23-10-5-11-24-31-25(32-34(23)24)30-20-14-12-19(13-15-20)7-6-18-33-16-3-4-17-33;1-32-24-11-3-2-9-22(24)23-10-6-12-25-28-26(29-31(23)25)27-21-15-13-20(14-16-21)8-7-19-30-17-4-5-18-30;26-19-10-13-21(23(32)17-19)22-6-3-7-24-28-25(29-31(22)24)27-20-11-8-18(9-12-20)5-4-16-30-14-1-2-15-30;1-32-24-25-16-19(17-26-24)21-7-4-8-22-28-23(29-31(21)22)27-20-11-9-18(10-12-20)6-5-15-30-13-2-3-14-30/h1-2,5,8-15H,3-4,6-7,16-18H2,(H,30,32);2-3,6,9-16H,4-5,7-8,17-19H2,1H3,(H,27,29);3,6-13,17,32H,1-2,4-5,14-16H2,(H,27,29);4,7-12,16-17H,2-3,5-6,13-15H2,1H3,(H,27,29)
InChIKeyUADJLFXOLYWBPD-UHFFFAOYSA-N
MW1754.12 g/mol
LogP20.34
Rot. Bonds30

About 5-fluoro-2-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenol;5-(2-methoxyphenyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxypyrimidin-5-yl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-[2-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine

5-fluoro-2-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenol;5-(2-methoxyphenyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxypyrimidin-5-yl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-[2-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine (PubChem CID 161035082) has the molecular formula C101H108F4N22O3 and a molecular weight of 1754.12 g/mol. Its IUPAC name is 5-fluoro-2-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenol;5-(2-methoxyphenyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxypyrimidin-5-yl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-[2-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine.

Molecular Properties

Compound Name5-fluoro-2-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenol;5-(2-methoxyphenyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxypyrimidin-5-yl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-[2-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
PubChem CID161035082
Molecular FormulaC101H108F4N22O3
Molecular Weight1754.12 g/mol
Exact Mass1752.89
IUPAC Name5-fluoro-2-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenol;5-(2-methoxyphenyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxypyrimidin-5-yl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-[2-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCOc1ccccc1-c1cccc2nc(Nc3ccc(CCCN4CCCC4)cc3)nn12.COc1ncc(-c2cccc3nc(Nc4ccc(CCCN5CCCC5)cc4)nn23)cn1.FC(F)(F)c1ccccc1-c1cccc2nc(Nc3ccc(CCCN4CCCC4)cc3)nn12.Oc1cc(F)ccc1-c1cccc2nc(Nc3ccc(CCCN4CCCC4)cc3)nn12
InChIInChI=1S/C26H26F3N5.C26H29N5O.C25H26FN5O.C24H27N7O/c27-26(28,29)22-9-2-1-8-21(22)23-10-5-11-24-31-25(32-34(23)24)30-20-14-12-19(13-15-20)7-6-18-33-16-3-4-17-33;1-32-24-11-3-2-9-22(24)23-10-6-12-25-28-26(29-31(23)25)27-21-15-13-20(14-16-21)8-7-19-30-17-4-5-18-30;26-19-10-13-21(23(32)17-19)22-6-3-7-24-28-25(29-31(22)24)27-20-11-8-18(9-12-20)5-4-16-30-14-1-2-15-30;1-32-24-25-16-19(17-26-24)21-7-4-8-22-28-23(29-31(21)22)27-20-11-9-18(10-12-20)6-5-15-30-13-2-3-14-30/h1-2,5,8-15H,3-4,6-7,16-18H2,(H,30,32);2-3,6,9-16H,4-5,7-8,17-19H2,1H3,(H,27,29);3,6-13,17,32H,1-2,4-5,14-16H2,(H,27,29);4,7-12,16-17H,2-3,5-6,13-15H2,1H3,(H,27,29)
InChIKeyUADJLFXOLYWBPD-UHFFFAOYSA-N
XLogP20.34
TPSA246.31 Ų
H-Bond Donors5
H-Bond Acceptors25
Rotatable Bonds30
Heavy Atoms130
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001754.12
LogP ≤ 520.34
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1025

Analyze 5-fluoro-2-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenol;5-(2-methoxyphenyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxypyrimidin-5-yl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-[2-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3,5-difluorophenyl)-8-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(3,5-difluorophenyl)-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(3-fluorophenyl)-8-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;8-(3-methoxyphenyl)-N-(2-methyl-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;8-(3-methoxyphenyl)-N-phenyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine;8-(3-methoxyphenyl)-N-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 157068880
N-[4-(difluoromethoxy)phenyl]-6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)pyrazin-2-amine;2-N-(4-methoxyphenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,3-diamine;5-[[6-(2-methylbenzimidazol-1-yl)pyrazin-2-yl]amino]-2-(trifluoromethyl)benzonitrile;[5-[[6-(2-methylbenzimidazol-1-yl)pyrazin-2-yl]amino]-2-(trifluoromethyl)phenyl]methanol;6-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine
CID 157096462
N-(4-chlorophenyl)-6-(6-fluoro-2-methylbenzimidazol-1-yl)pyrazin-2-amine;1-[6-[4-(difluoromethoxy)-3-fluoroanilino]pyrazin-2-yl]-N-[4-(difluoromethoxy)-3-fluorophenyl]-2-ethylimidazo[4,5-b]pyridin-6-amine;6-(2-ethyl-5-fluoropyrazolo[1,5-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(6-fluoro-2-methylbenzimidazol-1-yl)-N-(4-methoxyphenyl)pyrazin-2-amine;6-(6-fluoro-2-methylbenzimidazol-1-yl)-N-(4-methylphenyl)pyrazin-2-amine
CID 157131555
3-bromo-5-cyclohexyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine;3-bromo-5-cyclohexyl-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine;3-bromo-N-[[1-hydroxy-6-(2,2,2-trifluoroethoxy)pyridin-1-ium-3-yl]methyl]-5-phenylpyrazolo[1,5-a]pyrimidin-7-amine;[(1S,2R)-2-[3-bromo-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]cyclohexyl]methanol;2-[(1S)-2-[3-bromo-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]cyclohexyl]propan-2-ol
CID 157205293
2-N-[4-(difluoromethoxy)phenyl]-6-(4,6-difluoro-2-methylbenzimidazol-1-yl)pyrimidine-2,4-diamine;2-N-[4-(difluoromethoxy)phenyl]-6-[6-fluoro-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidine-2,4-diamine;6-(2-ethylbenzimidazol-1-yl)-5-fluoro-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;6-(2-ethyl-6-fluorobenzimidazol-1-yl)-5-fluoro-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;5-fluoro-6-(6-fluoro-2-methylbenzimidazol-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;5-fluoro-6-(2-methylbenzimidazol-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine
CID 157293772
N-(3,5-difluorophenyl)-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(3-fluorophenyl)-8-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;8-(2-fluorophenyl)-N-phenyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(3-fluorophenyl)-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(4-fluorophenyl)-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(2-methyl-4-pyridinyl)-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-phenyl-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 157307599
4-N-[4-(difluoromethoxy)-3-fluorophenyl]-5-fluoro-2-(5-fluoro-2-methylpyrazolo[1,5-a]pyridin-3-yl)pyrimidine-4,6-diamine;4-N-[4-(difluoromethoxy)phenyl]-2-(2-ethyl-5-fluoropyrazolo[1,5-a]pyridin-3-yl)-5-fluoropyrimidine-4,6-diamine;2-(2-ethyl-5-fluoropyrazolo[1,5-a]pyridin-3-yl)-5-fluoro-4-N-[4-(trifluoromethyl)phenyl]pyrimidine-4,6-diamine;5-fluoro-2-(6-fluoro-2-methylbenzimidazol-1-yl)-4-N-(3-methoxyphenyl)pyrimidine-4,6-diamine
CID 157351487
tetrakis(1-(4-fluorobenzene-6-id-1-yl)-3-(4-fluorophenyl)-4,5-dimethyl-2H-imidazol-3-ium-2-ide);tris(iridium);1-(4-methoxybenzene-6-id-1-yl)-4,5-dimethyl-3-(4-methylphenyl)-2H-imidazol-3-ium-2-ide;1-(4-methoxybenzene-6-id-1-yl)-3-(4-methoxyphenyl)-4,5-dimethyl-2H-imidazol-3-ium-2-ide;2-(5-methyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine;2-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)pyridine;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 157382116
2-chloro-N-[6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrazin-2-yl]pyrimidin-5-amine;N-[4-(difluoromethoxy)phenyl]-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)pyrazin-2-amine;2-methoxy-N-[6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrazin-2-yl]pyrimidin-5-amine;6-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;2-N-[4-(trifluoromethoxy)phenyl]-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyridine-2,4-diamine
CID 157493840
4-N-[4-(difluoromethoxy)phenyl]-2-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidine-4,6-diamine;2-(5,6-difluoro-2-methylbenzimidazol-1-yl)-4-N-[4-(trifluoromethyl)phenyl]pyrimidine-4,6-diamine;2-(2-methylbenzimidazol-1-yl)-4-N-[4-(trifluoromethyl)phenyl]pyrimidine-4,6-diamine;N-(4-methylphenyl)-2-[2-(trifluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-amine;2-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-4-N-[4-(trifluoromethyl)phenyl]pyrimidine-4,6-diamine
CID 157494669
(2S)-1-benzyl-5,5-difluoro-2-methylpiperidin-4-ol;(2S)-5,5-difluoro-1,2-dimethylpiperidin-4-ol;5-[(2R,4R)-5,5-difluoro-1,2-dimethylpiperidin-4-yl]oxy-N-[3-methyl-4-([1,2,4]triazolo[1,5-a]pyridin-7-yloxy)phenyl]quinazolin-4-amine;5-[(2S,4S)-5,5-difluoro-1,2-dimethylpiperidin-4-yl]oxy-N-[3-methyl-4-([1,2,4]triazolo[1,5-a]pyridin-7-yloxy)phenyl]quinazolin-4-amine;5-(5,5-difluoro-1,2-dimethylpiperidin-4-yl)oxy-N-[3-methyl-4-([1,2,4]triazolo[1,5-a]pyridin-7-yloxy)phenyl]quinazolin-4-amine;5-fluoro-N-[3-methyl-4-([1,2,4]triazolo[1,5-a]pyridin-7-yloxy)phenyl]quinazolin-4-amine
CID 157525949
3-[[3-(5-bromopyrimidin-2-yl)phenyl]-difluoromethyl]-N,N-dimethyl-[1,2,4]triazolo[4,3-b]pyridazin-6-amine;3-[[3-(5-bromopyrimidin-2-yl)phenyl]-difluoromethyl]-6-methoxy-[1,2,4]triazolo[4,3-b]pyridazine;3-[[3-(5-bromopyrimidin-2-yl)phenyl]-difluoromethyl]-6-phenoxy-[1,2,4]triazolo[4,3-b]pyridazine;3-[[3-(5-bromopyrimidin-2-yl)phenyl]-difluoromethyl]-N-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-6-amine;3-[[3-(5-bromopyrimidin-2-yl)phenyl]methyl]-N,N-dimethyl-[1,2,4]triazolo[4,3-b]pyridazin-6-amine;3-[[3-(5-bromopyrimidin-2-yl)phenyl]methyl]-6-methoxy-[1,2,4]triazolo[4,3-b]pyridazine
CID 157549360

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenol;5-(2-methoxyphenyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxypyrimidin-5-yl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-[2-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The IUPAC name of 5-fluoro-2-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenol;5-(2-methoxyphenyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxypyrimidin-5-yl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-[2-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine (CID 161035082) is 5-fluoro-2-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenol;5-(2-methoxyphenyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxypyrimidin-5-yl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-[2-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine.
What is the SMILES notation for 5-fluoro-2-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenol;5-(2-methoxyphenyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxypyrimidin-5-yl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-[2-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The canonical SMILES for 5-fluoro-2-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenol;5-(2-methoxyphenyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxypyrimidin-5-yl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-[2-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine is COc1ccccc1-c1cccc2nc(Nc3ccc(CCCN4CCCC4)cc3)nn12.COc1ncc(-c2cccc3nc(Nc4ccc(CCCN5CCCC5)cc4)nn23)cn1.FC(F)(F)c1ccccc1-c1cccc2nc(Nc3ccc(CCCN4CCCC4)cc3)nn12.Oc1cc(F)ccc1-c1cccc2nc(Nc3ccc(CCCN4CCCC4)cc3)nn12.
What is the InChIKey of 5-fluoro-2-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenol;5-(2-methoxyphenyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxypyrimidin-5-yl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-[2-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The InChIKey is UADJLFXOLYWBPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26F3N5.C26H29N5O.C25H26FN5O.C24H27N7O/c27-26(28,29)22-9-2-1-8-21(22)23-10-5-11-24-31-25(32-34(23)24)30-20-14-12-19(13-15-20)7-6-18-33-16-3-4-17-33;1-32-24-11-3-2-9-22(24)23-10-6-12-25-28-26(29-31(23)25)27-21-15-13-20(14-16-21)8-7-19-30-17-4-5-18-30;26-19-10-13-21(23(32)17-19)22-6-3-7-24-28-25(29-31(22)24)27-20-11-8-18(9-12-20)5-4-16-30-14-1-2-15-30;1-32-24-25-16-19(17-26-24)21-7-4-8-22-28-23(29-31(21)22)27-20-11-9-18(10-12-20)6-5-15-30-13-2-3-14-30/h1-2,5,8-15H,3-4,6-7,16-18H2,(H,30,32);2-3,6,9-16H,4-5,7-8,17-19H2,1H3,(H,27,29);3,6-13,17,32H,1-2,4-5,14-16H2,(H,27,29);4,7-12,16-17H,2-3,5-6,13-15H2,1H3,(H,27,29).
What are the key properties of 5-fluoro-2-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenol;5-(2-methoxyphenyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxypyrimidin-5-yl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-[2-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
5-fluoro-2-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenol;5-(2-methoxyphenyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxypyrimidin-5-yl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-[2-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine has a molecular weight of 1754.12 g/mol, XLogP of 20.34, 30 rotatable bonds, 5 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenol;5-(2-methoxyphenyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxypyrimidin-5-yl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-[2-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine is sourced from PubChem (CID 161035082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).