3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(2-phenylmorpholin-4-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4-phenylpiperidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(3-phenylpyrrolidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[3-(trifluoromethyl)piperidin-1-yl]propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[4-(trifluoromethyl)piperidin-1-yl]propan-1-one

C118H151F6N25O6 — CID 161107372

IUPAC3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(2-phenylmorpholin-4-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4-phenylpiperidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(3-phenylpyrrolidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[3-(trifluoromethyl)piperidin-1-yl]propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[4-(trifluoromethyl)piperidin-1-yl]propan-1-one
SMILESO=C(CCc1[nH]nc2ccnc(NC3CCCCC3)c12)N1CCC(C(F)(F)F)CC1.O=C(CCc1[nH]nc2ccnc(NC3CCCCC3)c12)N1CCC(c2ccccc2)C1.O=C(CCc1[nH]nc2ccnc(NC3CCCCC3)c12)N1CCC(c2ccccc2)CC1.O=C(CCc1[nH]nc2ccnc(NC3CCCCC3)c12)N1CCCC(C(F)(F)F)C1.O=C(CCc1[nH]nc2ccnc(NC3CCCCC3)c12)N1CCOC(c2ccccc2)C1
InChIInChI=1S/C26H33N5O.C25H31N5O2.C25H31N5O.2C21H28F3N5O/c32-24(31-17-14-20(15-18-31)19-7-3-1-4-8-19)12-11-22-25-23(30-29-22)13-16-27-26(25)28-21-9-5-2-6-10-21;31-23(30-15-16-32-22(17-30)18-7-3-1-4-8-18)12-11-20-24-21(29-28-20)13-14-26-25(24)27-19-9-5-2-6-10-19;31-23(30-16-14-19(17-30)18-7-3-1-4-8-18)12-11-21-24-22(29-28-21)13-15-26-25(24)27-20-9-5-2-6-10-20;22-21(23,24)14-5-4-12-29(13-14)18(30)9-8-16-19-17(28-27-16)10-11-25-20(19)26-15-6-2-1-3-7-15;22-21(23,24)14-9-12-29(13-10-14)18(30)7-6-16-19-17(28-27-16)8-11-25-20(19)26-15-4-2-1-3-5-15/h1,3-4,7-8,13,16,20-21H,2,5-6,9-12,14-15,17-18H2,(H,27,28)(H,29,30);1,3-4,7-8,13-14,19,22H,2,5-6,9-12,15-17H2,(H,26,27)(H,28,29);1,3-4,7-8,13,15,19-20H,2,5-6,9-12,14,16-17H2,(H,26,27)(H,28,29);10-11,14-15H,1-9,12-13H2,(H,25,26)(H,27,28);8,11,14-15H,1-7,9-10,12-13H2,(H,25,26)(H,27,28)
InChIKeyUJFUSVZBHHOKLI-UHFFFAOYSA-N
MW2129.66 g/mol
LogP22.80
Rot. Bonds28

About 3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(2-phenylmorpholin-4-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4-phenylpiperidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(3-phenylpyrrolidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[3-(trifluoromethyl)piperidin-1-yl]propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[4-(trifluoromethyl)piperidin-1-yl]propan-1-one

3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(2-phenylmorpholin-4-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4-phenylpiperidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(3-phenylpyrrolidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[3-(trifluoromethyl)piperidin-1-yl]propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[4-(trifluoromethyl)piperidin-1-yl]propan-1-one (PubChem CID 161107372) has the molecular formula C118H151F6N25O6 and a molecular weight of 2129.66 g/mol. Its IUPAC name is 3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(2-phenylmorpholin-4-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4-phenylpiperidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(3-phenylpyrrolidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[3-(trifluoromethyl)piperidin-1-yl]propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[4-(trifluoromethyl)piperidin-1-yl]propan-1-one.

Molecular Properties

Compound Name3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(2-phenylmorpholin-4-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4-phenylpiperidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(3-phenylpyrrolidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[3-(trifluoromethyl)piperidin-1-yl]propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[4-(trifluoromethyl)piperidin-1-yl]propan-1-one
PubChem CID161107372
Molecular FormulaC118H151F6N25O6
Molecular Weight2129.66 g/mol
Exact Mass2128.22
IUPAC Name3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(2-phenylmorpholin-4-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4-phenylpiperidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(3-phenylpyrrolidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[3-(trifluoromethyl)piperidin-1-yl]propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[4-(trifluoromethyl)piperidin-1-yl]propan-1-one
SMILESO=C(CCc1[nH]nc2ccnc(NC3CCCCC3)c12)N1CCC(C(F)(F)F)CC1.O=C(CCc1[nH]nc2ccnc(NC3CCCCC3)c12)N1CCC(c2ccccc2)C1.O=C(CCc1[nH]nc2ccnc(NC3CCCCC3)c12)N1CCC(c2ccccc2)CC1.O=C(CCc1[nH]nc2ccnc(NC3CCCCC3)c12)N1CCCC(C(F)(F)F)C1.O=C(CCc1[nH]nc2ccnc(NC3CCCCC3)c12)N1CCOC(c2ccccc2)C1
InChIInChI=1S/C26H33N5O.C25H31N5O2.C25H31N5O.2C21H28F3N5O/c32-24(31-17-14-20(15-18-31)19-7-3-1-4-8-19)12-11-22-25-23(30-29-22)13-16-27-26(25)28-21-9-5-2-6-10-21;31-23(30-15-16-32-22(17-30)18-7-3-1-4-8-18)12-11-20-24-21(29-28-20)13-14-26-25(24)27-19-9-5-2-6-10-19;31-23(30-16-14-19(17-30)18-7-3-1-4-8-18)12-11-21-24-22(29-28-21)13-15-26-25(24)27-20-9-5-2-6-10-20;22-21(23,24)14-5-4-12-29(13-14)18(30)9-8-16-19-17(28-27-16)10-11-25-20(19)26-15-6-2-1-3-7-15;22-21(23,24)14-9-12-29(13-10-14)18(30)7-6-16-19-17(28-27-16)8-11-25-20(19)26-15-4-2-1-3-5-15/h1,3-4,7-8,13,16,20-21H,2,5-6,9-12,14-15,17-18H2,(H,27,28)(H,29,30);1,3-4,7-8,13-14,19,22H,2,5-6,9-12,15-17H2,(H,26,27)(H,28,29);1,3-4,7-8,13,15,19-20H,2,5-6,9-12,14,16-17H2,(H,26,27)(H,28,29);10-11,14-15H,1-9,12-13H2,(H,25,26)(H,27,28);8,11,14-15H,1-7,9-10,12-13H2,(H,25,26)(H,27,28)
InChIKeyUJFUSVZBHHOKLI-UHFFFAOYSA-N
XLogP22.80
TPSA378.78 Ų
H-Bond Donors10
H-Bond Acceptors21
Rotatable Bonds28
Heavy Atoms155
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002129.66
LogP ≤ 522.80
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1021

Analyze 3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(2-phenylmorpholin-4-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4-phenylpiperidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(3-phenylpyrrolidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[3-(trifluoromethyl)piperidin-1-yl]propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[4-(trifluoromethyl)piperidin-1-yl]propan-1-one with MolForge

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Related Compounds

3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(3,3-difluoropiperidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-N-methyl-N-(2-phenylethyl)propanamide;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4-methylpiperidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[(3S)-3-phenylpiperidin-1-yl]propan-1-one;1-[3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]propanoyl]-N,N-diethylpiperidine-3-carboxamide;sulfane
CID 157371522
5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-[2-(dimethylamino)ethyl-methylamino]-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-[2-(dimethylamino)ethyl-methylamino]-3-pyridinyl]-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-[2-(dimethylamino)ethyl-methylamino]-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-[2-(dimethylamino)ethyl-methylamino]-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide
CID 157458865
1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-[[5-(trifluoromethyl)-2-pyridinyl]methoxy]pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-[2-(trifluoromethyl)pyrimidin-5-yl]pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-[5-(trifluoromethyl)pyrimidin-2-yl]pyridin-2-one;1-(2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-7-yl)-4-[6-(trifluoromethyl)pyridazin-3-yl]pyridin-2-one;1-(2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-7-yl)-4-[5-(trifluoromethyl)-2-pyridinyl]pyridin-2-one
CID 157460563
5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide
CID 157541863
N-cyclohexyl-N-methyl-4-[(3-methyl-2H-pyrazolo[4,3-c]pyridin-4-yl)amino]benzamide;N-cyclopentyl-4-[(3-methyl-2H-pyrazolo[4,3-c]pyridin-4-yl)amino]benzamide;(4,4-difluoropiperidin-1-yl)-[4-[(3-methyl-2H-pyrazolo[4,3-c]pyridin-4-yl)amino]phenyl]methanone;N-(2-methoxyethyl)-4-[(3-methyl-2H-pyrazolo[4,3-c]pyridin-4-yl)amino]benzamide;(4-methoxyphenyl)-[4-[(3-methyl-2H-pyrazolo[4,3-c]pyridin-4-yl)amino]cyclohexyl]methanone;N-methyl-4-[(3-methyl-2H-pyrazolo[4,3-c]pyridin-4-yl)amino]-N-phenylbenzamide
CID 157550007
3-cyano-N-[4-[2-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]ethyl]phenyl]benzamide;N-[4-[2-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]ethyl]phenyl]-3-fluorobenzamide;4-(cyclohexylmethoxy)-3-methyl-2H-pyrazolo[4,3-c]pyridine;3-methyl-4-(2-methylpropoxy)-2H-pyrazolo[4,3-c]pyridine;3-methyl-4-propan-2-yloxy-2H-pyrazolo[4,3-c]pyridine;3-methyl-4-(2,2,2-trifluoroethoxy)-2H-pyrazolo[4,3-c]pyridine
CID 157661552
5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide
CID 157778058
5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-[2-(dimethylamino)ethylamino]-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-[2-(dimethylamino)ethylamino]-3-pyridinyl]-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-[2-(dimethylamino)ethylamino]-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-[2-(dimethylamino)ethylamino]-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide
CID 157944867
N-cyclohexyl-N-methyl-4-[(3-methyl-2H-pyrazolo[4,3-c]pyridin-4-yl)amino]benzamide;N-cyclopentyl-4-[(3-methyl-2H-pyrazolo[4,3-c]pyridin-4-yl)amino]benzamide;(4,4-difluoropiperidin-1-yl)-[4-[(3-methyl-2H-pyrazolo[4,3-c]pyridin-4-yl)amino]phenyl]methanone;N-(2-methoxyethyl)-4-[(3-methyl-2H-pyrazolo[4,3-c]pyridin-4-yl)amino]benzamide;N-(2-methoxyphenyl)-4-[(3-methyl-2H-pyrazolo[4,3-c]pyridin-4-yl)amino]benzamide;N-methyl-4-[(3-methyl-2H-pyrazolo[4,3-c]pyridin-4-yl)amino]-N-phenylbenzamide
CID 158017550
5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide
CID 158487191
5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-phenyl-1H-indazole-3-carboxamide;5-[5-[(dimethylamino)methyl]-3-pyridinyl]-N-(6-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;5-(5-morpholin-4-yl-3-pyridinyl)-N-phenyl-1H-indazole-3-carboxamide;N-phenyl-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-phenyl-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide
CID 158669616
3-[4-(cyclohexylamino)-1H-pyrazolo[4,3-c]pyridin-3-yl]benzonitrile;[3-[4-(cyclohexylamino)-1H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-morpholin-4-ylmethanone;N-cyclohexyl-3-(3-methylphenyl)-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-(4-morpholin-4-ylphenyl)-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-(6-morpholin-4-yl-3-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-[2-(trifluoromethoxy)phenyl]-1H-pyrazolo[4,3-c]pyridin-4-amine
CID 158832814

Frequently Asked Questions

What is the IUPAC name of 3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(2-phenylmorpholin-4-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4-phenylpiperidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(3-phenylpyrrolidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[3-(trifluoromethyl)piperidin-1-yl]propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[4-(trifluoromethyl)piperidin-1-yl]propan-1-one?
The IUPAC name of 3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(2-phenylmorpholin-4-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4-phenylpiperidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(3-phenylpyrrolidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[3-(trifluoromethyl)piperidin-1-yl]propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[4-(trifluoromethyl)piperidin-1-yl]propan-1-one (CID 161107372) is 3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(2-phenylmorpholin-4-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4-phenylpiperidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(3-phenylpyrrolidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[3-(trifluoromethyl)piperidin-1-yl]propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[4-(trifluoromethyl)piperidin-1-yl]propan-1-one.
What is the SMILES notation for 3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(2-phenylmorpholin-4-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4-phenylpiperidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(3-phenylpyrrolidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[3-(trifluoromethyl)piperidin-1-yl]propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[4-(trifluoromethyl)piperidin-1-yl]propan-1-one?
The canonical SMILES for 3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(2-phenylmorpholin-4-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4-phenylpiperidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(3-phenylpyrrolidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[3-(trifluoromethyl)piperidin-1-yl]propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[4-(trifluoromethyl)piperidin-1-yl]propan-1-one is O=C(CCc1[nH]nc2ccnc(NC3CCCCC3)c12)N1CCC(C(F)(F)F)CC1.O=C(CCc1[nH]nc2ccnc(NC3CCCCC3)c12)N1CCC(c2ccccc2)C1.O=C(CCc1[nH]nc2ccnc(NC3CCCCC3)c12)N1CCC(c2ccccc2)CC1.O=C(CCc1[nH]nc2ccnc(NC3CCCCC3)c12)N1CCCC(C(F)(F)F)C1.O=C(CCc1[nH]nc2ccnc(NC3CCCCC3)c12)N1CCOC(c2ccccc2)C1.
What is the InChIKey of 3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(2-phenylmorpholin-4-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4-phenylpiperidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(3-phenylpyrrolidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[3-(trifluoromethyl)piperidin-1-yl]propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[4-(trifluoromethyl)piperidin-1-yl]propan-1-one?
The InChIKey is UJFUSVZBHHOKLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H33N5O.C25H31N5O2.C25H31N5O.2C21H28F3N5O/c32-24(31-17-14-20(15-18-31)19-7-3-1-4-8-19)12-11-22-25-23(30-29-22)13-16-27-26(25)28-21-9-5-2-6-10-21;31-23(30-15-16-32-22(17-30)18-7-3-1-4-8-18)12-11-20-24-21(29-28-20)13-14-26-25(24)27-19-9-5-2-6-10-19;31-23(30-16-14-19(17-30)18-7-3-1-4-8-18)12-11-21-24-22(29-28-21)13-15-26-25(24)27-20-9-5-2-6-10-20;22-21(23,24)14-5-4-12-29(13-14)18(30)9-8-16-19-17(28-27-16)10-11-25-20(19)26-15-6-2-1-3-7-15;22-21(23,24)14-9-12-29(13-10-14)18(30)7-6-16-19-17(28-27-16)8-11-25-20(19)26-15-4-2-1-3-5-15/h1,3-4,7-8,13,16,20-21H,2,5-6,9-12,14-15,17-18H2,(H,27,28)(H,29,30);1,3-4,7-8,13-14,19,22H,2,5-6,9-12,15-17H2,(H,26,27)(H,28,29);1,3-4,7-8,13,15,19-20H,2,5-6,9-12,14,16-17H2,(H,26,27)(H,28,29);10-11,14-15H,1-9,12-13H2,(H,25,26)(H,27,28);8,11,14-15H,1-7,9-10,12-13H2,(H,25,26)(H,27,28).
What are the key properties of 3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(2-phenylmorpholin-4-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4-phenylpiperidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(3-phenylpyrrolidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[3-(trifluoromethyl)piperidin-1-yl]propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[4-(trifluoromethyl)piperidin-1-yl]propan-1-one?
3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(2-phenylmorpholin-4-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4-phenylpiperidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(3-phenylpyrrolidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[3-(trifluoromethyl)piperidin-1-yl]propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[4-(trifluoromethyl)piperidin-1-yl]propan-1-one has a molecular weight of 2129.66 g/mol, XLogP of 22.80, 28 rotatable bonds, 10 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(2-phenylmorpholin-4-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4-phenylpiperidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(3-phenylpyrrolidin-1-yl)propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[3-(trifluoromethyl)piperidin-1-yl]propan-1-one;3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-[4-(trifluoromethyl)piperidin-1-yl]propan-1-one is sourced from PubChem (CID 161107372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).