3-amino-N-[3-(4-amino-3-methylpiperidin-1-yl)-2-pyridinyl]-6-[3-(trifluoromethoxy)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-[3,6-bis(trifluoromethyl)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(5-fluoro-7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(3-morpholin-4-ylphenyl)pyrazine-2-carboxamide;3-amino-6-(6-fluoroquinazolin-4-yl)-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;3-amino-6-[6-morpholin-4-yl-3-(trifluoromethyl)-2-pyridinyl]-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;methanamine

C140H152F14N52O9 — CID 157362098

IUPAC3-amino-N-[3-(4-amino-3-methylpiperidin-1-yl)-2-pyridinyl]-6-[3-(trifluoromethoxy)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-[3,6-bis(trifluoromethyl)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(5-fluoro-7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(3-morpholin-4-ylphenyl)pyrazine-2-carboxamide;3-amino-6-(6-fluoroquinazolin-4-yl)-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;3-amino-6-[6-morpholin-4-yl-3-(trifluoromethyl)-2-pyridinyl]-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;methanamine
SMILESCC1CN(c2cccnc2NC(=O)c2nc(-c3ncccc3OC(F)(F)F)cnc2N)CCC1N.CN.CN.Nc1ncc(-c2cccc(N3CCOCC3)c2)nc1C(=O)Nc1ncccc1N1CCC(N)CC1.Nc1ncc(-c2nc(C(F)(F)F)ccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)CC1.Nc1ncc(-c2nc(N3CCOCC3)ccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCCCC1.Nc1ncc(-c2ncnc3[nH]cc(F)c23)nc1C(=O)Nc1ncccc1N1CCC(N)CC1.Nc1ncc(-c2ncnc3ccc(F)cc23)nc1C(=O)Nc1ncccc1N1CCCCC1
InChIInChI=1S/C25H27F3N8O2.C25H30N8O2.C23H21FN8O.C22H20F6N8O.C22H23F3N8O2.C21H21FN10O.2CH5N/c26-25(27,28)16-6-7-19(36-11-13-38-14-12-36)33-20(16)17-15-31-22(29)21(32-17)24(37)34-23-18(5-4-8-30-23)35-9-2-1-3-10-35;26-18-6-9-33(10-7-18)21-5-2-8-28-24(21)31-25(34)22-23(27)29-16-20(30-22)17-3-1-4-19(15-17)32-11-13-35-14-12-32;24-14-6-7-16-15(11-14)19(29-13-28-16)17-12-27-21(25)20(30-17)23(33)31-22-18(5-4-8-26-22)32-9-2-1-3-10-32;23-21(24,25)12-3-4-15(22(26,27)28)34-16(12)13-10-32-18(30)17(33-13)20(37)35-19-14(2-1-7-31-19)36-8-5-11(29)6-9-36;1-12-11-33(9-6-13(12)26)15-4-2-8-29-20(15)32-21(34)18-19(27)30-10-14(31-18)17-16(5-3-7-28-17)35-22(23,24)25;22-12-8-27-20-15(12)16(28-10-29-20)13-9-26-18(24)17(30-13)21(33)31-19-14(2-1-5-25-19)32-6-3-11(23)4-7-32;2*1-2/h4-8,15H,1-3,9-14H2,(H2,29,31)(H,30,34,37);1-5,8,15-16,18H,6-7,9-14,26H2,(H2,27,29)(H,28,31,34);4-8,11-13H,1-3,9-10H2,(H2,25,27)(H,26,31,33);1-4,7,10-11H,5-6,8-9,29H2,(H2,30,32)(H,31,35,37);2-5,7-8,10,12-13H,6,9,11,26H2,1H3,(H2,27,30)(H,29,32,34);1-2,5,8-11H,3-4,6-7,23H2,(H2,24,26)(H,25,31,33)(H,27,28,29);2*2H2,1H3
InChIKeyBITJCXKFCPBMJN-UHFFFAOYSA-N
MW2973.08 g/mol
LogP16.63
Rot. Bonds27

About 3-amino-N-[3-(4-amino-3-methylpiperidin-1-yl)-2-pyridinyl]-6-[3-(trifluoromethoxy)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-[3,6-bis(trifluoromethyl)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(5-fluoro-7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(3-morpholin-4-ylphenyl)pyrazine-2-carboxamide;3-amino-6-(6-fluoroquinazolin-4-yl)-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;3-amino-6-[6-morpholin-4-yl-3-(trifluoromethyl)-2-pyridinyl]-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;methanamine

3-amino-N-[3-(4-amino-3-methylpiperidin-1-yl)-2-pyridinyl]-6-[3-(trifluoromethoxy)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-[3,6-bis(trifluoromethyl)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(5-fluoro-7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(3-morpholin-4-ylphenyl)pyrazine-2-carboxamide;3-amino-6-(6-fluoroquinazolin-4-yl)-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;3-amino-6-[6-morpholin-4-yl-3-(trifluoromethyl)-2-pyridinyl]-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;methanamine (PubChem CID 157362098) has the molecular formula C140H152F14N52O9 and a molecular weight of 2973.08 g/mol. Its IUPAC name is 3-amino-N-[3-(4-amino-3-methylpiperidin-1-yl)-2-pyridinyl]-6-[3-(trifluoromethoxy)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-[3,6-bis(trifluoromethyl)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(5-fluoro-7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(3-morpholin-4-ylphenyl)pyrazine-2-carboxamide;3-amino-6-(6-fluoroquinazolin-4-yl)-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;3-amino-6-[6-morpholin-4-yl-3-(trifluoromethyl)-2-pyridinyl]-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;methanamine.

Molecular Properties

Compound Name3-amino-N-[3-(4-amino-3-methylpiperidin-1-yl)-2-pyridinyl]-6-[3-(trifluoromethoxy)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-[3,6-bis(trifluoromethyl)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(5-fluoro-7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(3-morpholin-4-ylphenyl)pyrazine-2-carboxamide;3-amino-6-(6-fluoroquinazolin-4-yl)-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;3-amino-6-[6-morpholin-4-yl-3-(trifluoromethyl)-2-pyridinyl]-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;methanamine
PubChem CID157362098
Molecular FormulaC140H152F14N52O9
Molecular Weight2973.08 g/mol
Exact Mass2971.28
IUPAC Name3-amino-N-[3-(4-amino-3-methylpiperidin-1-yl)-2-pyridinyl]-6-[3-(trifluoromethoxy)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-[3,6-bis(trifluoromethyl)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(5-fluoro-7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(3-morpholin-4-ylphenyl)pyrazine-2-carboxamide;3-amino-6-(6-fluoroquinazolin-4-yl)-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;3-amino-6-[6-morpholin-4-yl-3-(trifluoromethyl)-2-pyridinyl]-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;methanamine
SMILESCC1CN(c2cccnc2NC(=O)c2nc(-c3ncccc3OC(F)(F)F)cnc2N)CCC1N.CN.CN.Nc1ncc(-c2cccc(N3CCOCC3)c2)nc1C(=O)Nc1ncccc1N1CCC(N)CC1.Nc1ncc(-c2nc(C(F)(F)F)ccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)CC1.Nc1ncc(-c2nc(N3CCOCC3)ccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCCCC1.Nc1ncc(-c2ncnc3[nH]cc(F)c23)nc1C(=O)Nc1ncccc1N1CCC(N)CC1.Nc1ncc(-c2ncnc3ccc(F)cc23)nc1C(=O)Nc1ncccc1N1CCCCC1
InChIInChI=1S/C25H27F3N8O2.C25H30N8O2.C23H21FN8O.C22H20F6N8O.C22H23F3N8O2.C21H21FN10O.2CH5N/c26-25(27,28)16-6-7-19(36-11-13-38-14-12-36)33-20(16)17-15-31-22(29)21(32-17)24(37)34-23-18(5-4-8-30-23)35-9-2-1-3-10-35;26-18-6-9-33(10-7-18)21-5-2-8-28-24(21)31-25(34)22-23(27)29-16-20(30-22)17-3-1-4-19(15-17)32-11-13-35-14-12-32;24-14-6-7-16-15(11-14)19(29-13-28-16)17-12-27-21(25)20(30-17)23(33)31-22-18(5-4-8-26-22)32-9-2-1-3-10-32;23-21(24,25)12-3-4-15(22(26,27)28)34-16(12)13-10-32-18(30)17(33-13)20(37)35-19-14(2-1-7-31-19)36-8-5-11(29)6-9-36;1-12-11-33(9-6-13(12)26)15-4-2-8-29-20(15)32-21(34)18-19(27)30-10-14(31-18)17-16(5-3-7-28-17)35-22(23,24)25;22-12-8-27-20-15(12)16(28-10-29-20)13-9-26-18(24)17(30-13)21(33)31-19-14(2-1-5-25-19)32-6-3-11(23)4-7-32;2*1-2/h4-8,15H,1-3,9-14H2,(H2,29,31)(H,30,34,37);1-5,8,15-16,18H,6-7,9-14,26H2,(H2,27,29)(H,28,31,34);4-8,11-13H,1-3,9-10H2,(H2,25,27)(H,26,31,33);1-4,7,10-11H,5-6,8-9,29H2,(H2,30,32)(H,31,35,37);2-5,7-8,10,12-13H,6,9,11,26H2,1H3,(H2,27,30)(H,29,32,34);1-2,5,8-11H,3-4,6-7,23H2,(H2,24,26)(H,25,31,33)(H,27,28,29);2*2H2,1H3
InChIKeyBITJCXKFCPBMJN-UHFFFAOYSA-N
XLogP16.63
TPSA878.49 Ų
H-Bond Donors19
H-Bond Acceptors54
Rotatable Bonds27
Heavy Atoms215
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002973.08
LogP ≤ 516.63
H-Bond Donors ≤ 519
H-Bond Acceptors ≤ 1054

Analyze 3-amino-N-[3-(4-amino-3-methylpiperidin-1-yl)-2-pyridinyl]-6-[3-(trifluoromethoxy)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-[3,6-bis(trifluoromethyl)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(5-fluoro-7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(3-morpholin-4-ylphenyl)pyrazine-2-carboxamide;3-amino-6-(6-fluoroquinazolin-4-yl)-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;3-amino-6-[6-morpholin-4-yl-3-(trifluoromethyl)-2-pyridinyl]-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;methanamine with MolForge

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Launch Full Analysis

Related Compounds

4-{5-[4-(6,7-Difluoro-3-quinolylamino)-2-pyrimidinylamino]-3-methoxy-2-pyridyl}-2-piperazinone
CID 176369403
8-[(2,6-difluorophenyl)methoxy]-N-[2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-yl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide
CID 86724783
8-[(2,6-difluorophenyl)methoxy]-2,6-dimethyl-N-[2-methyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-yl]imidazo[1,2-a]pyridine-3-carboxamide
CID 86724784
2-[2-[(2-fluorophenyl)methyl]-1H-pyrrolo[2,3-b]pyridin-4-yl]-5-methoxy-4-piperazin-1-ylpyrido[3,4-d]pyrimidine
CID 90099670
8-[(2,6-difluorophenyl)methoxy]-N-(6-fluoroquinolin-4-yl)-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide
CID 118142816
8-[(2,6-difluorophenyl)methoxy]-N-(8-fluoroquinolin-4-yl)-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide
CID 118142818
8-[(2,6-difluorophenyl)methoxy]-N-(6-fluoroquinolin-4-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 118144778
8-[(2,6-difluorophenyl)methoxy]-N-(8-fluoroquinolin-4-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 118144831
8-[(2,6-difluorophenyl)methoxy]-2-methyl-N-(2-methylquinolin-5-yl)imidazo[1,2-a]pyridine-3-carboxamide
CID 118144838
8-[(2,6-difluorophenyl)methoxy]-2-methyl-N-[7-(trifluoromethyl)quinolin-4-yl]imidazo[1,2-a]pyridine-3-carboxamide
CID 118144908
8-[(2,6-difluorophenyl)methoxy]-2-methyl-N-quinolin-5-ylimidazo[1,2-a]pyridine-3-carboxamide
CID 118144965
8-[(2,6-difluorophenyl)methoxy]-N-isoquinolin-5-yl-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 118144999

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[3-(4-amino-3-methylpiperidin-1-yl)-2-pyridinyl]-6-[3-(trifluoromethoxy)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-[3,6-bis(trifluoromethyl)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(5-fluoro-7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(3-morpholin-4-ylphenyl)pyrazine-2-carboxamide;3-amino-6-(6-fluoroquinazolin-4-yl)-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;3-amino-6-[6-morpholin-4-yl-3-(trifluoromethyl)-2-pyridinyl]-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;methanamine?
The IUPAC name of 3-amino-N-[3-(4-amino-3-methylpiperidin-1-yl)-2-pyridinyl]-6-[3-(trifluoromethoxy)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-[3,6-bis(trifluoromethyl)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(5-fluoro-7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(3-morpholin-4-ylphenyl)pyrazine-2-carboxamide;3-amino-6-(6-fluoroquinazolin-4-yl)-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;3-amino-6-[6-morpholin-4-yl-3-(trifluoromethyl)-2-pyridinyl]-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;methanamine (CID 157362098) is 3-amino-N-[3-(4-amino-3-methylpiperidin-1-yl)-2-pyridinyl]-6-[3-(trifluoromethoxy)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-[3,6-bis(trifluoromethyl)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(5-fluoro-7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(3-morpholin-4-ylphenyl)pyrazine-2-carboxamide;3-amino-6-(6-fluoroquinazolin-4-yl)-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;3-amino-6-[6-morpholin-4-yl-3-(trifluoromethyl)-2-pyridinyl]-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;methanamine.
What is the SMILES notation for 3-amino-N-[3-(4-amino-3-methylpiperidin-1-yl)-2-pyridinyl]-6-[3-(trifluoromethoxy)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-[3,6-bis(trifluoromethyl)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(5-fluoro-7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(3-morpholin-4-ylphenyl)pyrazine-2-carboxamide;3-amino-6-(6-fluoroquinazolin-4-yl)-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;3-amino-6-[6-morpholin-4-yl-3-(trifluoromethyl)-2-pyridinyl]-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;methanamine?
The canonical SMILES for 3-amino-N-[3-(4-amino-3-methylpiperidin-1-yl)-2-pyridinyl]-6-[3-(trifluoromethoxy)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-[3,6-bis(trifluoromethyl)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(5-fluoro-7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(3-morpholin-4-ylphenyl)pyrazine-2-carboxamide;3-amino-6-(6-fluoroquinazolin-4-yl)-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;3-amino-6-[6-morpholin-4-yl-3-(trifluoromethyl)-2-pyridinyl]-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;methanamine is CC1CN(c2cccnc2NC(=O)c2nc(-c3ncccc3OC(F)(F)F)cnc2N)CCC1N.CN.CN.Nc1ncc(-c2cccc(N3CCOCC3)c2)nc1C(=O)Nc1ncccc1N1CCC(N)CC1.Nc1ncc(-c2nc(C(F)(F)F)ccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)CC1.Nc1ncc(-c2nc(N3CCOCC3)ccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCCCC1.Nc1ncc(-c2ncnc3[nH]cc(F)c23)nc1C(=O)Nc1ncccc1N1CCC(N)CC1.Nc1ncc(-c2ncnc3ccc(F)cc23)nc1C(=O)Nc1ncccc1N1CCCCC1.
What is the InChIKey of 3-amino-N-[3-(4-amino-3-methylpiperidin-1-yl)-2-pyridinyl]-6-[3-(trifluoromethoxy)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-[3,6-bis(trifluoromethyl)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(5-fluoro-7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(3-morpholin-4-ylphenyl)pyrazine-2-carboxamide;3-amino-6-(6-fluoroquinazolin-4-yl)-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;3-amino-6-[6-morpholin-4-yl-3-(trifluoromethyl)-2-pyridinyl]-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;methanamine?
The InChIKey is BITJCXKFCPBMJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27F3N8O2.C25H30N8O2.C23H21FN8O.C22H20F6N8O.C22H23F3N8O2.C21H21FN10O.2CH5N/c26-25(27,28)16-6-7-19(36-11-13-38-14-12-36)33-20(16)17-15-31-22(29)21(32-17)24(37)34-23-18(5-4-8-30-23)35-9-2-1-3-10-35;26-18-6-9-33(10-7-18)21-5-2-8-28-24(21)31-25(34)22-23(27)29-16-20(30-22)17-3-1-4-19(15-17)32-11-13-35-14-12-32;24-14-6-7-16-15(11-14)19(29-13-28-16)17-12-27-21(25)20(30-17)23(33)31-22-18(5-4-8-26-22)32-9-2-1-3-10-32;23-21(24,25)12-3-4-15(22(26,27)28)34-16(12)13-10-32-18(30)17(33-13)20(37)35-19-14(2-1-7-31-19)36-8-5-11(29)6-9-36;1-12-11-33(9-6-13(12)26)15-4-2-8-29-20(15)32-21(34)18-19(27)30-10-14(31-18)17-16(5-3-7-28-17)35-22(23,24)25;22-12-8-27-20-15(12)16(28-10-29-20)13-9-26-18(24)17(30-13)21(33)31-19-14(2-1-5-25-19)32-6-3-11(23)4-7-32;2*1-2/h4-8,15H,1-3,9-14H2,(H2,29,31)(H,30,34,37);1-5,8,15-16,18H,6-7,9-14,26H2,(H2,27,29)(H,28,31,34);4-8,11-13H,1-3,9-10H2,(H2,25,27)(H,26,31,33);1-4,7,10-11H,5-6,8-9,29H2,(H2,30,32)(H,31,35,37);2-5,7-8,10,12-13H,6,9,11,26H2,1H3,(H2,27,30)(H,29,32,34);1-2,5,8-11H,3-4,6-7,23H2,(H2,24,26)(H,25,31,33)(H,27,28,29);2*2H2,1H3.
What are the key properties of 3-amino-N-[3-(4-amino-3-methylpiperidin-1-yl)-2-pyridinyl]-6-[3-(trifluoromethoxy)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-[3,6-bis(trifluoromethyl)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(5-fluoro-7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(3-morpholin-4-ylphenyl)pyrazine-2-carboxamide;3-amino-6-(6-fluoroquinazolin-4-yl)-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;3-amino-6-[6-morpholin-4-yl-3-(trifluoromethyl)-2-pyridinyl]-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;methanamine?
3-amino-N-[3-(4-amino-3-methylpiperidin-1-yl)-2-pyridinyl]-6-[3-(trifluoromethoxy)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-[3,6-bis(trifluoromethyl)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(5-fluoro-7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(3-morpholin-4-ylphenyl)pyrazine-2-carboxamide;3-amino-6-(6-fluoroquinazolin-4-yl)-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;3-amino-6-[6-morpholin-4-yl-3-(trifluoromethyl)-2-pyridinyl]-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;methanamine has a molecular weight of 2973.08 g/mol, XLogP of 16.63, 27 rotatable bonds, 19 hydrogen bond donors, and 54 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[3-(4-amino-3-methylpiperidin-1-yl)-2-pyridinyl]-6-[3-(trifluoromethoxy)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-[3,6-bis(trifluoromethyl)-2-pyridinyl]pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(5-fluoro-7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazine-2-carboxamide;3-amino-N-[3-(4-aminopiperidin-1-yl)-2-pyridinyl]-6-(3-morpholin-4-ylphenyl)pyrazine-2-carboxamide;3-amino-6-(6-fluoroquinazolin-4-yl)-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;3-amino-6-[6-morpholin-4-yl-3-(trifluoromethyl)-2-pyridinyl]-N-(3-piperidin-1-yl-2-pyridinyl)pyrazine-2-carboxamide;methanamine is sourced from PubChem (CID 157362098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).