3-amino-N-[2-[3-[1-(2-methoxyethyl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-(2-methyl-4-pyridinyl)-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-[1-(oxan-4-yl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-piperazin-1-yl-3-[4-(pyrrolidine-1-carbonyl)phenyl]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide

C118H137N23O7S4 — CID 157487525

IUPAC3-amino-N-[2-[3-[1-(2-methoxyethyl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-(2-methyl-4-pyridinyl)-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-[1-(oxan-4-yl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-piperazin-1-yl-3-[4-(pyrrolidine-1-carbonyl)phenyl]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide
SMILESCOCCn1cc(-c2cc(CCNC(=O)c3sc4nc(C)ccc4c3N)ccc2N2CCCCC2)cn1.Cc1cc(-c2cc(CCNC(=O)c3sc4nc(C)ccc4c3N)ccc2N2CCCCC2)ccn1.Cc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCCCC4)c(-c4cnn(C5CCOCC5)c4)c3)sc2n1.Cc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCNCC4)c(-c4ccc(C(=O)N5CCCC5)cc4)c3)sc2n1
InChIInChI=1S/C32H36N6O2S.C30H36N6O2S.C28H34N6O2S.C28H31N5OS/c1-21-4-10-25-28(33)29(41-31(25)36-21)30(39)35-13-12-22-5-11-27(37-18-14-34-15-19-37)26(20-22)23-6-8-24(9-7-23)32(40)38-16-2-3-17-38;1-20-5-7-24-27(31)28(39-30(24)34-20)29(37)32-12-9-21-6-8-26(35-13-3-2-4-14-35)25(17-21)22-18-33-36(19-22)23-10-15-38-16-11-23;1-19-6-8-22-25(29)26(37-28(22)32-19)27(35)30-11-10-20-7-9-24(33-12-4-3-5-13-33)23(16-20)21-17-31-34(18-21)14-15-36-2;1-18-6-8-22-25(29)26(35-28(22)32-18)27(34)31-12-10-20-7-9-24(33-14-4-3-5-15-33)23(17-20)21-11-13-30-19(2)16-21/h4-11,20,34H,2-3,12-19,33H2,1H3,(H,35,39);5-8,17-19,23H,2-4,9-16,31H2,1H3,(H,32,37);6-9,16-18H,3-5,10-15,29H2,1-2H3,(H,30,35);6-9,11,13,16-17H,3-5,10,12,14-15,29H2,1-2H3,(H,31,34)
InChIKeyBWWUAUGWCRKZDK-UHFFFAOYSA-N
MW2117.82 g/mol
LogP20.02
Rot. Bonds29

About 3-amino-N-[2-[3-[1-(2-methoxyethyl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-(2-methyl-4-pyridinyl)-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-[1-(oxan-4-yl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-piperazin-1-yl-3-[4-(pyrrolidine-1-carbonyl)phenyl]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide

3-amino-N-[2-[3-[1-(2-methoxyethyl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-(2-methyl-4-pyridinyl)-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-[1-(oxan-4-yl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-piperazin-1-yl-3-[4-(pyrrolidine-1-carbonyl)phenyl]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide (PubChem CID 157487525) has the molecular formula C118H137N23O7S4 and a molecular weight of 2117.82 g/mol. Its IUPAC name is 3-amino-N-[2-[3-[1-(2-methoxyethyl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-(2-methyl-4-pyridinyl)-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-[1-(oxan-4-yl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-piperazin-1-yl-3-[4-(pyrrolidine-1-carbonyl)phenyl]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-[2-[3-[1-(2-methoxyethyl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-(2-methyl-4-pyridinyl)-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-[1-(oxan-4-yl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-piperazin-1-yl-3-[4-(pyrrolidine-1-carbonyl)phenyl]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide
PubChem CID157487525
Molecular FormulaC118H137N23O7S4
Molecular Weight2117.82 g/mol
Exact Mass2116.00
IUPAC Name3-amino-N-[2-[3-[1-(2-methoxyethyl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-(2-methyl-4-pyridinyl)-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-[1-(oxan-4-yl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-piperazin-1-yl-3-[4-(pyrrolidine-1-carbonyl)phenyl]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide
SMILESCOCCn1cc(-c2cc(CCNC(=O)c3sc4nc(C)ccc4c3N)ccc2N2CCCCC2)cn1.Cc1cc(-c2cc(CCNC(=O)c3sc4nc(C)ccc4c3N)ccc2N2CCCCC2)ccn1.Cc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCCCC4)c(-c4cnn(C5CCOCC5)c4)c3)sc2n1.Cc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCNCC4)c(-c4ccc(C(=O)N5CCCC5)cc4)c3)sc2n1
InChIInChI=1S/C32H36N6O2S.C30H36N6O2S.C28H34N6O2S.C28H31N5OS/c1-21-4-10-25-28(33)29(41-31(25)36-21)30(39)35-13-12-22-5-11-27(37-18-14-34-15-19-37)26(20-22)23-6-8-24(9-7-23)32(40)38-16-2-3-17-38;1-20-5-7-24-27(31)28(39-30(24)34-20)29(37)32-12-9-21-6-8-26(35-13-3-2-4-14-35)25(17-21)22-18-33-36(19-22)23-10-15-38-16-11-23;1-19-6-8-22-25(29)26(37-28(22)32-19)27(35)30-11-10-20-7-9-24(33-12-4-3-5-13-33)23(16-20)21-17-31-34(18-21)14-15-36-2;1-18-6-8-22-25(29)26(35-28(22)32-18)27(34)31-12-10-20-7-9-24(33-14-4-3-5-15-33)23(17-20)21-11-13-30-19(2)16-21/h4-11,20,34H,2-3,12-19,33H2,1H3,(H,35,39);5-8,17-19,23H,2-4,9-16,31H2,1H3,(H,32,37);6-9,16-18H,3-5,10-15,29H2,1-2H3,(H,30,35);6-9,11,13,16-17H,3-5,10,12,14-15,29H2,1-2H3,(H,31,34)
InChIKeyBWWUAUGWCRKZDK-UHFFFAOYSA-N
XLogP20.02
TPSA384.33 Ų
H-Bond Donors9
H-Bond Acceptors29
Rotatable Bonds29
Heavy Atoms152
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002117.82
LogP ≤ 520.02
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1029

Analyze 3-amino-N-[2-[3-[1-(2-methoxyethyl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-(2-methyl-4-pyridinyl)-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-[1-(oxan-4-yl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-piperazin-1-yl-3-[4-(pyrrolidine-1-carbonyl)phenyl]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide with MolForge

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Related Compounds

3-amino-N-[2-[3-[1-(2-methoxyethyl)pyrazol-4-yl]-4-piperazin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide
CID 147340937
3-amino-6-methyl-N-[2-[3-[1-(oxan-4-yl)pyrazol-4-yl]-4-piperazin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide
CID 153311088
3-tert-butyl-N-cyclopropylbenzamide;3-tert-butyl-N,N-dimethylbenzamide;3-tert-butyl-N-(2-methoxyethyl)benzamide;3-tert-butyl-N-methylbenzamide;3-(4-tert-butylphenyl)-2,6-dimethylpyridine;3-(4-tert-butylphenyl)-4-methylpyridine;1,3-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;2-methyl-5-propan-2-ylindazole;1-methyl-4-(4-propan-2-ylphenyl)-3-(trifluoromethyl)pyrazole;4-(3-propan-2-ylphenyl)pyridine;5-(4-propan-2-ylphenyl)-1,3-thiazole;4-(4-propan-2-ylphenyl)-1-(2,2,2-trifluoroethyl)pyrazole
CID 158905619
4-methyl-N-[1-[(6-methyl-3-pyridinyl)methyl]indol-3-yl]-1,3-thiazole-5-carboxamide;4-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,3-thiazole-5-carboxamide;N-[1-[(6-methyl-3-pyridinyl)methyl]indol-3-yl]pyridazine-3-carboxamide;N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]pyridazine-3-carboxamide
CID 160640351
N-[2-[6-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]-7-[3-[3-[[2-[6-(morpholin-4-ylmethyl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]phenyl]carbamoyl]pyrazol-1-yl]phenyl]-[1,3]thiazolo[5,4-b]pyridin-2-yl]phenyl]-1-phenylpyrazole-3-carboxamide
CID 145536834
bis(5-amino-3,4-dimethyl-N-[(5-methyl-2-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide);5-amino-3,4-dimethyl-N-[1-(5-methylthiophen-2-yl)sulfonylpyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(3-phenylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(4-phenylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-3-methylbenzamide;5-amino-N-[1-(3-ethylphenyl)sulfonylpyrrolidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide
CID 157202641
2-fluoro-N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-6-methylbenzamide;3-fluoro-N-[[7-(3-methoxypropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-5-methylpyridine-4-carboxamide;methane;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-2-methylbenzamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-3-methylpyridine-4-carboxamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-pyridin-4-ylmethyl]-2-methylsulfanylpyridine-3-carboxamide;N-[(7-methyl-7-azabicyclo[2.2.1]heptan-1-yl)-phenylmethyl]-1H-indazole-3-carboxamide;3-methyl-N-[[7-(2-methylpropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]pyridine-4-carboxamide
CID 157285345
3-amino-N-[2-[4-(7-azaspiro[4.5]decan-7-yl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[3-(4-chlorophenyl)-4-piperidin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[4-[3-(cyclopropylmethyl)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[3-[1-(difluoromethyl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-[methyl(piperidin-3-ylmethyl)amino]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-(6-oxa-2-azaspiro[4.5]decan-2-yl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide
CID 157532013
3-amino-N-[2-[3-(2-fluorophenyl)-4-piperidin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[3-(3-fluorophenyl)-4-piperidin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[3-(4-fluorophenyl)-4-piperidin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-(3-methylphenyl)-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-(4-methylphenyl)-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide
CID 157533866
3-amino-N-[2-[3-(2-chlorophenyl)-4-piperidin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[3-(3-chlorophenyl)-4-piperidin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[3-(4-chlorophenyl)-4-piperidin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[3-[1-(difluoromethyl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-(2-methylphenyl)-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide
CID 157728510
N-[2-[6-[(4-aminopiperidin-1-yl)methyl]-[1,3]thiazolo[5,4-b]pyridin-2-yl]phenyl]-3-phenylbenzamide;6-(3-fluorophenyl)-N-[2-[6-(morpholin-4-ylmethyl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]phenyl]pyridine-2-carboxamide;N-[2-[6-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]-[1,3]thiazolo[5,4-b]pyridin-2-yl]phenyl]-3-phenylbenzamide;N-[2-[6-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]-[1,3]thiazolo[5,4-b]pyridin-2-yl]phenyl]-6-phenylpyridine-2-carboxamide;N-[2-[6-(morpholin-4-ylmethyl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]phenyl]-6-phenylpyridine-2-carboxamide;3-phenyl-N-[2-[6-(piperazin-1-ylmethyl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]phenyl]benzamide
CID 157873894
5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-[(1-methylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyridine-3-carboxamide;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-pyridin-4-ylpyrazolo[1,5-a]pyridine-3-carboxamide;6-[2-(2-fluorophenyl)-3-pyridinyl]-1,3-benzothiazole;6-[2-(3-fluorophenyl)-3-pyridinyl]-1,3-benzothiazole
CID 157912380

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-[3-[1-(2-methoxyethyl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-(2-methyl-4-pyridinyl)-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-[1-(oxan-4-yl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-piperazin-1-yl-3-[4-(pyrrolidine-1-carbonyl)phenyl]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 3-amino-N-[2-[3-[1-(2-methoxyethyl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-(2-methyl-4-pyridinyl)-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-[1-(oxan-4-yl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-piperazin-1-yl-3-[4-(pyrrolidine-1-carbonyl)phenyl]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide (CID 157487525) is 3-amino-N-[2-[3-[1-(2-methoxyethyl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-(2-methyl-4-pyridinyl)-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-[1-(oxan-4-yl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-piperazin-1-yl-3-[4-(pyrrolidine-1-carbonyl)phenyl]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-[2-[3-[1-(2-methoxyethyl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-(2-methyl-4-pyridinyl)-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-[1-(oxan-4-yl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-piperazin-1-yl-3-[4-(pyrrolidine-1-carbonyl)phenyl]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-[2-[3-[1-(2-methoxyethyl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-(2-methyl-4-pyridinyl)-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-[1-(oxan-4-yl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-piperazin-1-yl-3-[4-(pyrrolidine-1-carbonyl)phenyl]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide is COCCn1cc(-c2cc(CCNC(=O)c3sc4nc(C)ccc4c3N)ccc2N2CCCCC2)cn1.Cc1cc(-c2cc(CCNC(=O)c3sc4nc(C)ccc4c3N)ccc2N2CCCCC2)ccn1.Cc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCCCC4)c(-c4cnn(C5CCOCC5)c4)c3)sc2n1.Cc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCNCC4)c(-c4ccc(C(=O)N5CCCC5)cc4)c3)sc2n1.
What is the InChIKey of 3-amino-N-[2-[3-[1-(2-methoxyethyl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-(2-methyl-4-pyridinyl)-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-[1-(oxan-4-yl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-piperazin-1-yl-3-[4-(pyrrolidine-1-carbonyl)phenyl]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is BWWUAUGWCRKZDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H36N6O2S.C30H36N6O2S.C28H34N6O2S.C28H31N5OS/c1-21-4-10-25-28(33)29(41-31(25)36-21)30(39)35-13-12-22-5-11-27(37-18-14-34-15-19-37)26(20-22)23-6-8-24(9-7-23)32(40)38-16-2-3-17-38;1-20-5-7-24-27(31)28(39-30(24)34-20)29(37)32-12-9-21-6-8-26(35-13-3-2-4-14-35)25(17-21)22-18-33-36(19-22)23-10-15-38-16-11-23;1-19-6-8-22-25(29)26(37-28(22)32-19)27(35)30-11-10-20-7-9-24(33-12-4-3-5-13-33)23(16-20)21-17-31-34(18-21)14-15-36-2;1-18-6-8-22-25(29)26(35-28(22)32-18)27(34)31-12-10-20-7-9-24(33-14-4-3-5-15-33)23(17-20)21-11-13-30-19(2)16-21/h4-11,20,34H,2-3,12-19,33H2,1H3,(H,35,39);5-8,17-19,23H,2-4,9-16,31H2,1H3,(H,32,37);6-9,16-18H,3-5,10-15,29H2,1-2H3,(H,30,35);6-9,11,13,16-17H,3-5,10,12,14-15,29H2,1-2H3,(H,31,34).
What are the key properties of 3-amino-N-[2-[3-[1-(2-methoxyethyl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-(2-methyl-4-pyridinyl)-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-[1-(oxan-4-yl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-piperazin-1-yl-3-[4-(pyrrolidine-1-carbonyl)phenyl]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide?
3-amino-N-[2-[3-[1-(2-methoxyethyl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-(2-methyl-4-pyridinyl)-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-[1-(oxan-4-yl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-piperazin-1-yl-3-[4-(pyrrolidine-1-carbonyl)phenyl]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 2117.82 g/mol, XLogP of 20.02, 29 rotatable bonds, 9 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-[3-[1-(2-methoxyethyl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-(2-methyl-4-pyridinyl)-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[3-[1-(oxan-4-yl)pyrazol-4-yl]-4-piperidin-1-ylphenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-piperazin-1-yl-3-[4-(pyrrolidine-1-carbonyl)phenyl]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 157487525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).