N-benzyl-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;N-(cyclopenta-1,4-dien-1-ylmethyl)-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;1,3-dihydroisoindol-2-yl-[5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-2-pyridinyl]methanone;N-[(4-methoxyphenyl)methyl]-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(3-methylphenyl)methyl]pyridine-2-carboxamide;bis(5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(4-methylphenyl)methyl]pyridine-2-carboxamide);5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(5-methyl-2-pyridinyl)methyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(1R)-1-phenylethyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide

C223H219N71O11S — CID 167555705

IUPACN-benzyl-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;N-(cyclopenta-1,4-dien-1-ylmethyl)-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;1,3-dihydroisoindol-2-yl-[5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-2-pyridinyl]methanone;N-[(4-methoxyphenyl)methyl]-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(3-methylphenyl)methyl]pyridine-2-carboxamide;bis(5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(4-methylphenyl)methyl]pyridine-2-carboxamide);5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(5-methyl-2-pyridinyl)methyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(1R)-1-phenylethyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide
SMILESCOc1ccc(CNC(=O)c2ccc(-c3nc(C)cc(Nc4cc(C)[nH]n4)n3)cn2)cc1.Cc1cc(Nc2cc(C)[nH]n2)nc(-c2ccc(C(=O)N3Cc4ccccc4C3)nc2)n1.Cc1cc(Nc2cc(C)[nH]n2)nc(-c2ccc(C(=O)NCC3=CCC=C3)nc2)n1.Cc1cc(Nc2cc(C)[nH]n2)nc(-c2ccc(C(=O)NCc3ccccc3)nc2)n1.Cc1cc(Nc2cc(C)[nH]n2)nc(-c2ccc(C(=O)NCc3cccs3)nc2)n1.Cc1cc(Nc2cc(C)[nH]n2)nc(-c2ccc(C(=O)N[C@H](C)c3ccccc3)nc2)n1.Cc1ccc(CNC(=O)c2ccc(-c3nc(C)cc(Nc4cc(C)[nH]n4)n3)cn2)cc1.Cc1ccc(CNC(=O)c2ccc(-c3nc(C)cc(Nc4cc(C)[nH]n4)n3)cn2)cc1.Cc1ccc(CNC(=O)c2ccc(-c3nc(C)cc(Nc4cc(C)[nH]n4)n3)cn2)nc1.Cc1cccc(CNC(=O)c2ccc(-c3nc(C)cc(Nc4cc(C)[nH]n4)n3)cn2)c1
InChIInChI=1S/C23H23N7O2.C23H21N7O.4C23H23N7O.C22H22N8O.C22H21N7O.C21H21N7O.C20H19N7OS/c1-14-10-20(27-21-11-15(2)29-30-21)28-22(26-14)17-6-9-19(24-13-17)23(31)25-12-16-4-7-18(32-3)8-5-16;1-14-9-20(26-21-10-15(2)28-29-21)27-22(25-14)16-7-8-19(24-11-16)23(31)30-12-17-5-3-4-6-18(17)13-30;2*1-14-4-6-17(7-5-14)12-25-23(31)19-9-8-18(13-24-19)22-26-15(2)10-20(28-22)27-21-11-16(3)29-30-21;1-14-5-4-6-17(9-14)12-25-23(31)19-8-7-18(13-24-19)22-26-15(2)10-20(28-22)27-21-11-16(3)29-30-21;1-14-11-20(27-21-12-15(2)29-30-21)28-22(25-14)18-9-10-19(24-13-18)23(31)26-16(3)17-7-5-4-6-8-17;1-13-4-6-17(23-10-13)12-25-22(31)18-7-5-16(11-24-18)21-26-14(2)8-19(28-21)27-20-9-15(3)29-30-20;1-14-10-19(26-20-11-15(2)28-29-20)27-21(25-14)17-8-9-18(23-13-17)22(30)24-12-16-6-4-3-5-7-16;1-13-9-18(25-19-10-14(2)27-28-19)26-20(24-13)16-7-8-17(22-12-16)21(29)23-11-15-5-3-4-6-15;1-12-8-17(24-18-9-13(2)26-27-18)25-19(23-12)14-5-6-16(21-10-14)20(28)22-11-15-4-3-7-29-15/h4-11,13H,12H2,1-3H3,(H,25,31)(H2,26,27,28,29,30);3-11H,12-13H2,1-2H3,(H2,25,26,27,28,29);3*4-11,13H,12H2,1-3H3,(H,25,31)(H2,26,27,28,29,30);4-13,16H,1-3H3,(H,26,31)(H2,25,27,28,29,30);4-11H,12H2,1-3H3,(H,25,31)(H2,26,27,28,29,30);3-11,13H,12H2,1-2H3,(H,24,30)(H2,25,26,27,28,29);3,5-10,12H,4,11H2,1-2H3,(H,23,29)(H2,24,25,26,27,28);3-10H,11H2,1-2H3,(H,22,28)(H2,23,24,25,26,27)/t;;;;;16-;;;;/m.....1..../s1
InChIKeyCZFBWHRBUIYEFM-APQTVPTASA-N
MW4101.76 g/mol
LogP36.69
Rot. Bonds59

About N-benzyl-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;N-(cyclopenta-1,4-dien-1-ylmethyl)-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;1,3-dihydroisoindol-2-yl-[5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-2-pyridinyl]methanone;N-[(4-methoxyphenyl)methyl]-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(3-methylphenyl)methyl]pyridine-2-carboxamide;bis(5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(4-methylphenyl)methyl]pyridine-2-carboxamide);5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(5-methyl-2-pyridinyl)methyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(1R)-1-phenylethyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide

N-benzyl-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;N-(cyclopenta-1,4-dien-1-ylmethyl)-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;1,3-dihydroisoindol-2-yl-[5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-2-pyridinyl]methanone;N-[(4-methoxyphenyl)methyl]-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(3-methylphenyl)methyl]pyridine-2-carboxamide;bis(5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(4-methylphenyl)methyl]pyridine-2-carboxamide);5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(5-methyl-2-pyridinyl)methyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(1R)-1-phenylethyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide (PubChem CID 167555705) has the molecular formula C223H219N71O11S and a molecular weight of 4101.76 g/mol. Its IUPAC name is N-benzyl-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;N-(cyclopenta-1,4-dien-1-ylmethyl)-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;1,3-dihydroisoindol-2-yl-[5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-2-pyridinyl]methanone;N-[(4-methoxyphenyl)methyl]-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(3-methylphenyl)methyl]pyridine-2-carboxamide;bis(5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(4-methylphenyl)methyl]pyridine-2-carboxamide);5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(5-methyl-2-pyridinyl)methyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(1R)-1-phenylethyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-benzyl-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;N-(cyclopenta-1,4-dien-1-ylmethyl)-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;1,3-dihydroisoindol-2-yl-[5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-2-pyridinyl]methanone;N-[(4-methoxyphenyl)methyl]-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(3-methylphenyl)methyl]pyridine-2-carboxamide;bis(5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(4-methylphenyl)methyl]pyridine-2-carboxamide);5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(5-methyl-2-pyridinyl)methyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(1R)-1-phenylethyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide
PubChem CID167555705
Molecular FormulaC223H219N71O11S
Molecular Weight4101.76 g/mol
Exact Mass4098.85
IUPAC NameN-benzyl-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;N-(cyclopenta-1,4-dien-1-ylmethyl)-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;1,3-dihydroisoindol-2-yl-[5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-2-pyridinyl]methanone;N-[(4-methoxyphenyl)methyl]-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(3-methylphenyl)methyl]pyridine-2-carboxamide;bis(5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(4-methylphenyl)methyl]pyridine-2-carboxamide);5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(5-methyl-2-pyridinyl)methyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(1R)-1-phenylethyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide
SMILESCOc1ccc(CNC(=O)c2ccc(-c3nc(C)cc(Nc4cc(C)[nH]n4)n3)cn2)cc1.Cc1cc(Nc2cc(C)[nH]n2)nc(-c2ccc(C(=O)N3Cc4ccccc4C3)nc2)n1.Cc1cc(Nc2cc(C)[nH]n2)nc(-c2ccc(C(=O)NCC3=CCC=C3)nc2)n1.Cc1cc(Nc2cc(C)[nH]n2)nc(-c2ccc(C(=O)NCc3ccccc3)nc2)n1.Cc1cc(Nc2cc(C)[nH]n2)nc(-c2ccc(C(=O)NCc3cccs3)nc2)n1.Cc1cc(Nc2cc(C)[nH]n2)nc(-c2ccc(C(=O)N[C@H](C)c3ccccc3)nc2)n1.Cc1ccc(CNC(=O)c2ccc(-c3nc(C)cc(Nc4cc(C)[nH]n4)n3)cn2)cc1.Cc1ccc(CNC(=O)c2ccc(-c3nc(C)cc(Nc4cc(C)[nH]n4)n3)cn2)cc1.Cc1ccc(CNC(=O)c2ccc(-c3nc(C)cc(Nc4cc(C)[nH]n4)n3)cn2)nc1.Cc1cccc(CNC(=O)c2ccc(-c3nc(C)cc(Nc4cc(C)[nH]n4)n3)cn2)c1
InChIInChI=1S/C23H23N7O2.C23H21N7O.4C23H23N7O.C22H22N8O.C22H21N7O.C21H21N7O.C20H19N7OS/c1-14-10-20(27-21-11-15(2)29-30-21)28-22(26-14)17-6-9-19(24-13-17)23(31)25-12-16-4-7-18(32-3)8-5-16;1-14-9-20(26-21-10-15(2)28-29-21)27-22(25-14)16-7-8-19(24-11-16)23(31)30-12-17-5-3-4-6-18(17)13-30;2*1-14-4-6-17(7-5-14)12-25-23(31)19-9-8-18(13-24-19)22-26-15(2)10-20(28-22)27-21-11-16(3)29-30-21;1-14-5-4-6-17(9-14)12-25-23(31)19-8-7-18(13-24-19)22-26-15(2)10-20(28-22)27-21-11-16(3)29-30-21;1-14-11-20(27-21-12-15(2)29-30-21)28-22(25-14)18-9-10-19(24-13-18)23(31)26-16(3)17-7-5-4-6-8-17;1-13-4-6-17(23-10-13)12-25-22(31)18-7-5-16(11-24-18)21-26-14(2)8-19(28-21)27-20-9-15(3)29-30-20;1-14-10-19(26-20-11-15(2)28-29-20)27-21(25-14)17-8-9-18(23-13-17)22(30)24-12-16-6-4-3-5-7-16;1-13-9-18(25-19-10-14(2)27-28-19)26-20(24-13)16-7-8-17(22-12-16)21(29)23-11-15-5-3-4-6-15;1-12-8-17(24-18-9-13(2)26-27-18)25-19(23-12)14-5-6-16(21-10-14)20(28)22-11-15-4-3-7-29-15/h4-11,13H,12H2,1-3H3,(H,25,31)(H2,26,27,28,29,30);3-11H,12-13H2,1-2H3,(H2,25,26,27,28,29);3*4-11,13H,12H2,1-3H3,(H,25,31)(H2,26,27,28,29,30);4-13,16H,1-3H3,(H,26,31)(H2,25,27,28,29,30);4-11H,12H2,1-3H3,(H,25,31)(H2,26,27,28,29,30);3-11,13H,12H2,1-2H3,(H,24,30)(H2,25,26,27,28,29);3,5-10,12H,4,11H2,1-2H3,(H,23,29)(H2,24,25,26,27,28);3-10H,11H2,1-2H3,(H,22,28)(H2,23,24,25,26,27)/t;;;;;16-;;;;/m.....1..../s1
InChIKeyCZFBWHRBUIYEFM-APQTVPTASA-N
XLogP36.69
TPSA1098.13 Ų
H-Bond Donors29
H-Bond Acceptors63
Rotatable Bonds59
Heavy Atoms306
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004101.76
LogP ≤ 536.69
H-Bond Donors ≤ 529
H-Bond Acceptors ≤ 1063

Analyze N-benzyl-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;N-(cyclopenta-1,4-dien-1-ylmethyl)-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;1,3-dihydroisoindol-2-yl-[5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-2-pyridinyl]methanone;N-[(4-methoxyphenyl)methyl]-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(3-methylphenyl)methyl]pyridine-2-carboxamide;bis(5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(4-methylphenyl)methyl]pyridine-2-carboxamide);5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(5-methyl-2-pyridinyl)methyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(1R)-1-phenylethyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;N-(cyclopenta-1,4-dien-1-ylmethyl)-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;1,3-dihydroisoindol-2-yl-[5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-2-pyridinyl]methanone;N-[(4-methoxyphenyl)methyl]-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(3-methylphenyl)methyl]pyridine-2-carboxamide;bis(5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(4-methylphenyl)methyl]pyridine-2-carboxamide);5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(5-methyl-2-pyridinyl)methyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(1R)-1-phenylethyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide?
The IUPAC name of N-benzyl-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;N-(cyclopenta-1,4-dien-1-ylmethyl)-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;1,3-dihydroisoindol-2-yl-[5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-2-pyridinyl]methanone;N-[(4-methoxyphenyl)methyl]-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(3-methylphenyl)methyl]pyridine-2-carboxamide;bis(5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(4-methylphenyl)methyl]pyridine-2-carboxamide);5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(5-methyl-2-pyridinyl)methyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(1R)-1-phenylethyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide (CID 167555705) is N-benzyl-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;N-(cyclopenta-1,4-dien-1-ylmethyl)-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;1,3-dihydroisoindol-2-yl-[5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-2-pyridinyl]methanone;N-[(4-methoxyphenyl)methyl]-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(3-methylphenyl)methyl]pyridine-2-carboxamide;bis(5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(4-methylphenyl)methyl]pyridine-2-carboxamide);5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(5-methyl-2-pyridinyl)methyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(1R)-1-phenylethyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide.
What is the SMILES notation for N-benzyl-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;N-(cyclopenta-1,4-dien-1-ylmethyl)-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;1,3-dihydroisoindol-2-yl-[5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-2-pyridinyl]methanone;N-[(4-methoxyphenyl)methyl]-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(3-methylphenyl)methyl]pyridine-2-carboxamide;bis(5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(4-methylphenyl)methyl]pyridine-2-carboxamide);5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(5-methyl-2-pyridinyl)methyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(1R)-1-phenylethyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide?
The canonical SMILES for N-benzyl-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;N-(cyclopenta-1,4-dien-1-ylmethyl)-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;1,3-dihydroisoindol-2-yl-[5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-2-pyridinyl]methanone;N-[(4-methoxyphenyl)methyl]-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(3-methylphenyl)methyl]pyridine-2-carboxamide;bis(5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(4-methylphenyl)methyl]pyridine-2-carboxamide);5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(5-methyl-2-pyridinyl)methyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(1R)-1-phenylethyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide is COc1ccc(CNC(=O)c2ccc(-c3nc(C)cc(Nc4cc(C)[nH]n4)n3)cn2)cc1.Cc1cc(Nc2cc(C)[nH]n2)nc(-c2ccc(C(=O)N3Cc4ccccc4C3)nc2)n1.Cc1cc(Nc2cc(C)[nH]n2)nc(-c2ccc(C(=O)NCC3=CCC=C3)nc2)n1.Cc1cc(Nc2cc(C)[nH]n2)nc(-c2ccc(C(=O)NCc3ccccc3)nc2)n1.Cc1cc(Nc2cc(C)[nH]n2)nc(-c2ccc(C(=O)NCc3cccs3)nc2)n1.Cc1cc(Nc2cc(C)[nH]n2)nc(-c2ccc(C(=O)N[C@H](C)c3ccccc3)nc2)n1.Cc1ccc(CNC(=O)c2ccc(-c3nc(C)cc(Nc4cc(C)[nH]n4)n3)cn2)cc1.Cc1ccc(CNC(=O)c2ccc(-c3nc(C)cc(Nc4cc(C)[nH]n4)n3)cn2)cc1.Cc1ccc(CNC(=O)c2ccc(-c3nc(C)cc(Nc4cc(C)[nH]n4)n3)cn2)nc1.Cc1cccc(CNC(=O)c2ccc(-c3nc(C)cc(Nc4cc(C)[nH]n4)n3)cn2)c1.
What is the InChIKey of N-benzyl-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;N-(cyclopenta-1,4-dien-1-ylmethyl)-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;1,3-dihydroisoindol-2-yl-[5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-2-pyridinyl]methanone;N-[(4-methoxyphenyl)methyl]-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(3-methylphenyl)methyl]pyridine-2-carboxamide;bis(5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(4-methylphenyl)methyl]pyridine-2-carboxamide);5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(5-methyl-2-pyridinyl)methyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(1R)-1-phenylethyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide?
The InChIKey is CZFBWHRBUIYEFM-APQTVPTASA-N. The full InChI is InChI=1S/C23H23N7O2.C23H21N7O.4C23H23N7O.C22H22N8O.C22H21N7O.C21H21N7O.C20H19N7OS/c1-14-10-20(27-21-11-15(2)29-30-21)28-22(26-14)17-6-9-19(24-13-17)23(31)25-12-16-4-7-18(32-3)8-5-16;1-14-9-20(26-21-10-15(2)28-29-21)27-22(25-14)16-7-8-19(24-11-16)23(31)30-12-17-5-3-4-6-18(17)13-30;2*1-14-4-6-17(7-5-14)12-25-23(31)19-9-8-18(13-24-19)22-26-15(2)10-20(28-22)27-21-11-16(3)29-30-21;1-14-5-4-6-17(9-14)12-25-23(31)19-8-7-18(13-24-19)22-26-15(2)10-20(28-22)27-21-11-16(3)29-30-21;1-14-11-20(27-21-12-15(2)29-30-21)28-22(25-14)18-9-10-19(24-13-18)23(31)26-16(3)17-7-5-4-6-8-17;1-13-4-6-17(23-10-13)12-25-22(31)18-7-5-16(11-24-18)21-26-14(2)8-19(28-21)27-20-9-15(3)29-30-20;1-14-10-19(26-20-11-15(2)28-29-20)27-21(25-14)17-8-9-18(23-13-17)22(30)24-12-16-6-4-3-5-7-16;1-13-9-18(25-19-10-14(2)27-28-19)26-20(24-13)16-7-8-17(22-12-16)21(29)23-11-15-5-3-4-6-15;1-12-8-17(24-18-9-13(2)26-27-18)25-19(23-12)14-5-6-16(21-10-14)20(28)22-11-15-4-3-7-29-15/h4-11,13H,12H2,1-3H3,(H,25,31)(H2,26,27,28,29,30);3-11H,12-13H2,1-2H3,(H2,25,26,27,28,29);3*4-11,13H,12H2,1-3H3,(H,25,31)(H2,26,27,28,29,30);4-13,16H,1-3H3,(H,26,31)(H2,25,27,28,29,30);4-11H,12H2,1-3H3,(H,25,31)(H2,26,27,28,29,30);3-11,13H,12H2,1-2H3,(H,24,30)(H2,25,26,27,28,29);3,5-10,12H,4,11H2,1-2H3,(H,23,29)(H2,24,25,26,27,28);3-10H,11H2,1-2H3,(H,22,28)(H2,23,24,25,26,27)/t;;;;;16-;;;;/m.....1..../s1.
What are the key properties of N-benzyl-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;N-(cyclopenta-1,4-dien-1-ylmethyl)-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;1,3-dihydroisoindol-2-yl-[5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-2-pyridinyl]methanone;N-[(4-methoxyphenyl)methyl]-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(3-methylphenyl)methyl]pyridine-2-carboxamide;bis(5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(4-methylphenyl)methyl]pyridine-2-carboxamide);5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(5-methyl-2-pyridinyl)methyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(1R)-1-phenylethyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide?
N-benzyl-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;N-(cyclopenta-1,4-dien-1-ylmethyl)-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;1,3-dihydroisoindol-2-yl-[5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-2-pyridinyl]methanone;N-[(4-methoxyphenyl)methyl]-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(3-methylphenyl)methyl]pyridine-2-carboxamide;bis(5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(4-methylphenyl)methyl]pyridine-2-carboxamide);5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(5-methyl-2-pyridinyl)methyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(1R)-1-phenylethyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide has a molecular weight of 4101.76 g/mol, XLogP of 36.69, 59 rotatable bonds, 29 hydrogen bond donors, and 63 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;N-(cyclopenta-1,4-dien-1-ylmethyl)-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;1,3-dihydroisoindol-2-yl-[5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-2-pyridinyl]methanone;N-[(4-methoxyphenyl)methyl]-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(3-methylphenyl)methyl]pyridine-2-carboxamide;bis(5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(4-methylphenyl)methyl]pyridine-2-carboxamide);5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(5-methyl-2-pyridinyl)methyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-[(1R)-1-phenylethyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide is sourced from PubChem (CID 167555705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).