5-[6-(dimethylamino)-3-pyridinyl]-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxy-3-pyridinyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;methyl 4-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]benzoate;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine

C101H113N23O3S — CID 159433237

IUPAC5-[6-(dimethylamino)-3-pyridinyl]-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxy-3-pyridinyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;methyl 4-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]benzoate;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCN(C)c1ccc(-c2cccc3nc(Nc4ccc(CCCN5CCCC5)cc4)nn23)cn1.COC(=O)c1ccc(-c2cccc3nc(Nc4ccc(CCCN5CCCC5)cc4)nn23)cc1.COc1ncccc1-c1cccc2nc(Nc3ccc(CCCN4CCCC4)cc3)nn12.c1cc(-c2ccsc2)n2nc(Nc3ccc(CCCN4CCCC4)cc3)nc2c1
InChIInChI=1S/C27H29N5O2.C26H31N7.C25H28N6O.C23H25N5S/c1-34-26(33)22-13-11-21(12-14-22)24-7-4-8-25-29-27(30-32(24)25)28-23-15-9-20(10-16-23)6-5-19-31-17-2-3-18-31;1-31(2)24-15-12-21(19-27-24)23-8-5-9-25-29-26(30-33(23)25)28-22-13-10-20(11-14-22)7-6-18-32-16-3-4-17-32;1-32-24-21(8-5-15-26-24)22-9-4-10-23-28-25(29-31(22)23)27-20-13-11-19(12-14-20)7-6-18-30-16-2-3-17-30;1-2-14-27(13-1)15-4-5-18-8-10-20(11-9-18)24-23-25-22-7-3-6-21(28(22)26-23)19-12-16-29-17-19/h4,7-16H,2-3,5-6,17-19H2,1H3,(H,28,30);5,8-15,19H,3-4,6-7,16-18H2,1-2H3,(H,28,30);4-5,8-15H,2-3,6-7,16-18H2,1H3,(H,27,29);3,6-12,16-17H,1-2,4-5,13-15H2,(H,24,26)
InChIKeyLRGBUIQYWWVNSX-UHFFFAOYSA-N
MW1729.24 g/mol
LogP19.39
Rot. Bonds31

About 5-[6-(dimethylamino)-3-pyridinyl]-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxy-3-pyridinyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;methyl 4-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]benzoate;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine

5-[6-(dimethylamino)-3-pyridinyl]-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxy-3-pyridinyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;methyl 4-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]benzoate;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine (PubChem CID 159433237) has the molecular formula C101H113N23O3S and a molecular weight of 1729.24 g/mol. Its IUPAC name is 5-[6-(dimethylamino)-3-pyridinyl]-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxy-3-pyridinyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;methyl 4-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]benzoate;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine.

Molecular Properties

Compound Name5-[6-(dimethylamino)-3-pyridinyl]-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxy-3-pyridinyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;methyl 4-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]benzoate;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine
PubChem CID159433237
Molecular FormulaC101H113N23O3S
Molecular Weight1729.24 g/mol
Exact Mass1727.91
IUPAC Name5-[6-(dimethylamino)-3-pyridinyl]-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxy-3-pyridinyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;methyl 4-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]benzoate;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCN(C)c1ccc(-c2cccc3nc(Nc4ccc(CCCN5CCCC5)cc4)nn23)cn1.COC(=O)c1ccc(-c2cccc3nc(Nc4ccc(CCCN5CCCC5)cc4)nn23)cc1.COc1ncccc1-c1cccc2nc(Nc3ccc(CCCN4CCCC4)cc3)nn12.c1cc(-c2ccsc2)n2nc(Nc3ccc(CCCN4CCCC4)cc3)nc2c1
InChIInChI=1S/C27H29N5O2.C26H31N7.C25H28N6O.C23H25N5S/c1-34-26(33)22-13-11-21(12-14-22)24-7-4-8-25-29-27(30-32(24)25)28-23-15-9-20(10-16-23)6-5-19-31-17-2-3-18-31;1-31(2)24-15-12-21(19-27-24)23-8-5-9-25-29-26(30-33(23)25)28-22-13-10-20(11-14-22)7-6-18-32-16-3-4-17-32;1-32-24-21(8-5-15-26-24)22-9-4-10-23-28-25(29-31(22)23)27-20-13-11-19(12-14-20)7-6-18-30-16-2-3-17-30;1-2-14-27(13-1)15-4-5-18-8-10-20(11-9-18)24-23-25-22-7-3-6-21(28(22)26-23)19-12-16-29-17-19/h4,7-16H,2-3,5-6,17-19H2,1H3,(H,28,30);5,8-15,19H,3-4,6-7,16-18H2,1-2H3,(H,28,30);4-5,8-15H,2-3,6-7,16-18H2,1H3,(H,27,29);3,6-12,16-17H,1-2,4-5,13-15H2,(H,24,26)
InChIKeyLRGBUIQYWWVNSX-UHFFFAOYSA-N
XLogP19.39
TPSA246.39 Ų
H-Bond Donors4
H-Bond Acceptors27
Rotatable Bonds31
Heavy Atoms128
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001729.24
LogP ≤ 519.39
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1027

Analyze 5-[6-(dimethylamino)-3-pyridinyl]-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxy-3-pyridinyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;methyl 4-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]benzoate;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-thiophen-3-yl-[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

methane;bis(3-[[2-methoxy-6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine);bis(3-[[2-methyl-6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine);6-[2-(4-methylphenyl)ethyl]-3-(1H-pyrrolo[2,3-b]pyridin-3-ylmethyl)-1H-pyridin-2-one;3-[[6-(2-phenylethyl)-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine;3-[[6-(2-thiophen-2-ylethyl)-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine
CID 157386127
6-Cyclopropyl-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;6-(furan-3-yl)-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-6-phenyl-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-3-yl-6-prop-1-en-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-3-yl-6-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-3-yl-6-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-3-yl-6-thiophen-3-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 157775528
bis(3-[[2-methoxy-6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine);bis(3-[[2-methyl-6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine);6-[2-(4-methylphenyl)ethyl]-3-(1H-pyrrolo[2,3-b]pyridin-3-ylmethyl)-1H-pyridin-2-one;3-[[6-(2-phenylethyl)-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine;3-[[6-(2-thiophen-2-ylethyl)-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine
CID 157861303
N'-[1-(3,4-dimethylphenyl)-3-phenylpyrazol-5-yl]propanediamide;5-[1-(3,4-dimethylphenyl)-3-phenylpyrazol-5-yl]thiophene-2-carboxamide;4-[1-(3,4-dimethylphenyl)-3-pyridin-3-ylpyrazol-5-yl]benzamide;N-[5-[1-(3,4-dimethylphenyl)-5-thiophen-3-ylpyrazol-3-yl]-2-pyridinyl]-N',N'-di(propan-2-yl)ethane-1,2-diamine;4-[5-(4-methoxyphenyl)-1-(4-methylphenyl)pyrazol-3-yl]pyrimidine
CID 159181700
bis(3-[[2-methoxy-6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine);bis(3-[[2-methyl-6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine);3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine;6-[2-(4-methylphenyl)ethyl]-3-(1H-pyrrolo[2,3-b]pyridin-3-ylmethyl)-1H-pyridin-2-one;3-[[6-(2-phenylethyl)-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine;3-[[6-(2-thiophen-2-ylethyl)-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine
CID 159267060
6-(Furan-3-yl)-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-6-phenyl-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-3-yl-6-prop-1-en-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-3-yl-6-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-3-yl-6-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-3-yl-6-thiophen-3-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 159336359
6-Cyclopropyl-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;6-(furan-3-yl)-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-6-phenyl-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-3-yl-6-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-3-yl-6-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-3-yl-6-thiophen-3-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 159345222
3-[5-(aminomethyl)thiophen-2-yl]-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3-aminophenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(2-aminopyrimidin-5-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(1H-indol-6-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(5-methoxythiophen-3-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(3-methyl-1H-indol-5-yl)pyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(3-methyl-1H-indol-6-yl)pyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(2-methylpyrimidin-5-yl)pyrazolo[3,4-d]pyrimidin-4-amine
CID 159697389
5-[7-amino-3-(4-chlorophenyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-2-carboxylic acid;[4-(7-amino-6-chloro-3-quinolin-3-ylpyrazolo[1,5-a]pyrimidin-5-yl)-3,6-dihydro-2H-pyridin-1-yl]-thiophen-2-ylmethanone;5-[7-amino-3-(2-methoxy-4-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-2-carboxylic acid;5-[7-amino-3-(4-phenylphenyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-2-carboxylic acid;6-chloro-3-quinolin-3-yl-5-(1,2,3,6-tetrahydropyridin-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 159851593
5-[4-(furan-2-yl)phenyl]-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-[4-(2-methylpyrazol-3-yl)phenyl]-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-[4-(1H-pyrazol-4-yl)phenyl]-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-(4-thiophen-3-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 159946341
N,N-diethyl-3-methyl-1-(2-methylphenyl)-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide;N-ethyl-6-phenyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide;methyl 1-(2-cyanoethyl)-6-(2-methoxyphenyl)-3-methylpyrazolo[5,4-b]pyridine-4-carboxylate
CID 162200414
CID 164966678
CID 164966678

Frequently Asked Questions

What is the IUPAC name of 5-[6-(dimethylamino)-3-pyridinyl]-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxy-3-pyridinyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;methyl 4-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]benzoate;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The IUPAC name of 5-[6-(dimethylamino)-3-pyridinyl]-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxy-3-pyridinyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;methyl 4-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]benzoate;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine (CID 159433237) is 5-[6-(dimethylamino)-3-pyridinyl]-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxy-3-pyridinyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;methyl 4-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]benzoate;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine.
What is the SMILES notation for 5-[6-(dimethylamino)-3-pyridinyl]-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxy-3-pyridinyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;methyl 4-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]benzoate;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The canonical SMILES for 5-[6-(dimethylamino)-3-pyridinyl]-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxy-3-pyridinyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;methyl 4-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]benzoate;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine is CN(C)c1ccc(-c2cccc3nc(Nc4ccc(CCCN5CCCC5)cc4)nn23)cn1.COC(=O)c1ccc(-c2cccc3nc(Nc4ccc(CCCN5CCCC5)cc4)nn23)cc1.COc1ncccc1-c1cccc2nc(Nc3ccc(CCCN4CCCC4)cc3)nn12.c1cc(-c2ccsc2)n2nc(Nc3ccc(CCCN4CCCC4)cc3)nc2c1.
What is the InChIKey of 5-[6-(dimethylamino)-3-pyridinyl]-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxy-3-pyridinyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;methyl 4-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]benzoate;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The InChIKey is LRGBUIQYWWVNSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H29N5O2.C26H31N7.C25H28N6O.C23H25N5S/c1-34-26(33)22-13-11-21(12-14-22)24-7-4-8-25-29-27(30-32(24)25)28-23-15-9-20(10-16-23)6-5-19-31-17-2-3-18-31;1-31(2)24-15-12-21(19-27-24)23-8-5-9-25-29-26(30-33(23)25)28-22-13-10-20(11-14-22)7-6-18-32-16-3-4-17-32;1-32-24-21(8-5-15-26-24)22-9-4-10-23-28-25(29-31(22)23)27-20-13-11-19(12-14-20)7-6-18-30-16-2-3-17-30;1-2-14-27(13-1)15-4-5-18-8-10-20(11-9-18)24-23-25-22-7-3-6-21(28(22)26-23)19-12-16-29-17-19/h4,7-16H,2-3,5-6,17-19H2,1H3,(H,28,30);5,8-15,19H,3-4,6-7,16-18H2,1-2H3,(H,28,30);4-5,8-15H,2-3,6-7,16-18H2,1H3,(H,27,29);3,6-12,16-17H,1-2,4-5,13-15H2,(H,24,26).
What are the key properties of 5-[6-(dimethylamino)-3-pyridinyl]-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxy-3-pyridinyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;methyl 4-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]benzoate;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
5-[6-(dimethylamino)-3-pyridinyl]-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxy-3-pyridinyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;methyl 4-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]benzoate;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine has a molecular weight of 1729.24 g/mol, XLogP of 19.39, 31 rotatable bonds, 4 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[6-(dimethylamino)-3-pyridinyl]-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(2-methoxy-3-pyridinyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;methyl 4-[2-[4-(3-pyrrolidin-1-ylpropyl)anilino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]benzoate;N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]-5-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine is sourced from PubChem (CID 159433237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).