1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(6-cyano-3-pyridinyl)cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[2-(4-methylpiperazin-1-yl)-4-pyridinyl]cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclohexane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclopropane-1-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide

C120H117N31O6S3 — CID 159482284

IUPAC1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(6-cyano-3-pyridinyl)cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[2-(4-methylpiperazin-1-yl)-4-pyridinyl]cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclohexane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclopropane-1-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide
SMILESCN1CCN(c2cc(NC(=O)C3(c4ccc(-c5cnc(N)nc5)cc4)CCC3)ccn2)CC1.Cc1nc(-c2ccc(NC(=O)C3(c4ccc(-c5cnc(N)nc5)cc4)CC3)nc2)cs1.Cc1nc(-c2ccc(NC(=O)C3(c4ccc(-c5cnc(N)nc5)cc4)CCCCC3)nc2)cs1.Cc1nc(-c2ccc(NC(=O)C3(c4ccc(-c5cnc(N)nc5)cc4)CCOCC3)nc2)cs1.N#Cc1ccc(NC(=O)C2(c3ccc(-c4cnc(N)nc4)cc3)CCC2)cn1
InChIInChI=1S/C26H26N6OS.C25H29N7O.C25H24N6O2S.C23H20N6OS.C21H18N6O/c1-17-31-22(16-34-17)19-7-10-23(28-13-19)32-24(33)26(11-3-2-4-12-26)21-8-5-18(6-9-21)20-14-29-25(27)30-15-20;1-31-11-13-32(14-12-31)22-15-21(7-10-27-22)30-23(33)25(8-2-9-25)20-5-3-18(4-6-20)19-16-28-24(26)29-17-19;1-16-30-21(15-34-16)18-4-7-22(27-12-18)31-23(32)25(8-10-33-11-9-25)20-5-2-17(3-6-20)19-13-28-24(26)29-14-19;1-14-28-19(13-31-14)16-4-7-20(25-10-16)29-21(30)23(8-9-23)18-5-2-15(3-6-18)17-11-26-22(24)27-12-17;22-10-17-6-7-18(13-24-17)27-19(28)21(8-1-9-21)16-4-2-14(3-5-16)15-11-25-20(23)26-12-15/h5-10,13-16H,2-4,11-12H2,1H3,(H2,27,29,30)(H,28,32,33);3-7,10,15-17H,2,8-9,11-14H2,1H3,(H2,26,28,29)(H,27,30,33);2-7,12-15H,8-11H2,1H3,(H2,26,28,29)(H,27,31,32);2-7,10-13H,8-9H2,1H3,(H2,24,26,27)(H,25,29,30);2-7,11-13H,1,8-9H2,(H,27,28)(H2,23,25,26)
InChIKeyLXDLXVWWANHEBS-UHFFFAOYSA-N
MW2185.67 g/mol
LogP19.84
Rot. Bonds24

About 1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(6-cyano-3-pyridinyl)cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[2-(4-methylpiperazin-1-yl)-4-pyridinyl]cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclohexane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclopropane-1-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide

1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(6-cyano-3-pyridinyl)cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[2-(4-methylpiperazin-1-yl)-4-pyridinyl]cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclohexane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclopropane-1-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide (PubChem CID 159482284) has the molecular formula C120H117N31O6S3 and a molecular weight of 2185.67 g/mol. Its IUPAC name is 1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(6-cyano-3-pyridinyl)cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[2-(4-methylpiperazin-1-yl)-4-pyridinyl]cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclohexane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclopropane-1-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide.

Molecular Properties

Compound Name1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(6-cyano-3-pyridinyl)cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[2-(4-methylpiperazin-1-yl)-4-pyridinyl]cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclohexane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclopropane-1-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide
PubChem CID159482284
Molecular FormulaC120H117N31O6S3
Molecular Weight2185.67 g/mol
Exact Mass2183.90
IUPAC Name1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(6-cyano-3-pyridinyl)cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[2-(4-methylpiperazin-1-yl)-4-pyridinyl]cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclohexane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclopropane-1-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide
SMILESCN1CCN(c2cc(NC(=O)C3(c4ccc(-c5cnc(N)nc5)cc4)CCC3)ccn2)CC1.Cc1nc(-c2ccc(NC(=O)C3(c4ccc(-c5cnc(N)nc5)cc4)CC3)nc2)cs1.Cc1nc(-c2ccc(NC(=O)C3(c4ccc(-c5cnc(N)nc5)cc4)CCCCC3)nc2)cs1.Cc1nc(-c2ccc(NC(=O)C3(c4ccc(-c5cnc(N)nc5)cc4)CCOCC3)nc2)cs1.N#Cc1ccc(NC(=O)C2(c3ccc(-c4cnc(N)nc4)cc3)CCC2)cn1
InChIInChI=1S/C26H26N6OS.C25H29N7O.C25H24N6O2S.C23H20N6OS.C21H18N6O/c1-17-31-22(16-34-17)19-7-10-23(28-13-19)32-24(33)26(11-3-2-4-12-26)21-8-5-18(6-9-21)20-14-29-25(27)30-15-20;1-31-11-13-32(14-12-31)22-15-21(7-10-27-22)30-23(33)25(8-2-9-25)20-5-3-18(4-6-20)19-16-28-24(26)29-17-19;1-16-30-21(15-34-16)18-4-7-22(27-12-18)31-23(32)25(8-10-33-11-9-25)20-5-2-17(3-6-20)19-13-28-24(26)29-14-19;1-14-28-19(13-31-14)16-4-7-20(25-10-16)29-21(30)23(8-9-23)18-5-2-15(3-6-18)17-11-26-22(24)27-12-17;22-10-17-6-7-18(13-24-17)27-19(28)21(8-1-9-21)16-4-2-14(3-5-16)15-11-25-20(23)26-12-15/h5-10,13-16H,2-4,11-12H2,1H3,(H2,27,29,30)(H,28,32,33);3-7,10,15-17H,2,8-9,11-14H2,1H3,(H2,26,28,29)(H,27,30,33);2-7,12-15H,8-11H2,1H3,(H2,26,28,29)(H,27,31,32);2-7,10-13H,8-9H2,1H3,(H2,24,26,27)(H,25,29,30);2-7,11-13H,1,8-9H2,(H,27,28)(H2,23,25,26)
InChIKeyLXDLXVWWANHEBS-UHFFFAOYSA-N
XLogP19.84
TPSA547.12 Ų
H-Bond Donors10
H-Bond Acceptors35
Rotatable Bonds24
Heavy Atoms160
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002185.67
LogP ≤ 519.84
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1035

Analyze 1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(6-cyano-3-pyridinyl)cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[2-(4-methylpiperazin-1-yl)-4-pyridinyl]cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclohexane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclopropane-1-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide with MolForge

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Related Compounds

4-[4-(5-amino-6-methoxypyrazin-2-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(5-cyano-6-methyl-2-pyridinyl)oxane-4-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-pyridin-4-ylcyclobutane-1-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[6-(trifluoromethyl)-3-pyridinyl]oxane-4-carboxamide
CID 158175644
1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(4,5-dimethyl-1,3-thiazol-2-yl)cyclobutane-1-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[3-fluoro-4-(trifluoromethyl)phenyl]oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-isoquinolin-3-yloxane-4-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(5-methyl-2-pyridinyl)cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(5-methyl-1,3-thiazol-2-yl)cyclobutane-1-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]oxane-4-carboxamide
CID 158321979
4-[4-[6-amino-5-(hydroxymethyl)-3-pyridinyl]phenyl]-N-(5-cyano-2-pyridinyl)oxane-4-carboxamide;4-[4-(5-amino-6-methylpyrazin-2-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(2-methoxy-4-pyridinyl)cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(2-methyl-4-pyridinyl)cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-pyridin-3-ylcyclobutane-1-carboxamide
CID 157877765
4-[4-(5-amino-6-methylpyrazin-2-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(1,3-benzothiazol-2-yl)oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(4-benzylphenyl)oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[3-(4-methylpiperazin-1-yl)phenyl]oxane-4-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-pyridin-3-ylcyclobutane-1-carboxamide
CID 159744430
4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(1-methylpyrazol-4-yl)-2-pyridinyl]oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(4-methyl-2-pyridinyl)oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(5-methyl-2-pyridinyl)oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(6-methyl-2-pyridinyl)oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide
CID 161587877
2-[4-(2-aminopyrimidin-5-yl)phenyl]-2-cyclopentyl-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]acetamide;2-[4-(2-aminopyrimidin-5-yl)phenyl]-2,3-dimethyl-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]butanamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(6-methyl-3-pyridinyl)cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]cyclohexane-1-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]oxane-4-carboxamide
CID 161918040
1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(4-cyanophenyl)cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[2-(4-methylpiperazin-1-yl)-4-pyridinyl]cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclohexane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclopropane-1-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide
CID 161998573

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(6-cyano-3-pyridinyl)cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[2-(4-methylpiperazin-1-yl)-4-pyridinyl]cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclohexane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclopropane-1-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide?
The IUPAC name of 1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(6-cyano-3-pyridinyl)cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[2-(4-methylpiperazin-1-yl)-4-pyridinyl]cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclohexane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclopropane-1-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide (CID 159482284) is 1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(6-cyano-3-pyridinyl)cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[2-(4-methylpiperazin-1-yl)-4-pyridinyl]cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclohexane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclopropane-1-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide.
What is the SMILES notation for 1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(6-cyano-3-pyridinyl)cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[2-(4-methylpiperazin-1-yl)-4-pyridinyl]cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclohexane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclopropane-1-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide?
The canonical SMILES for 1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(6-cyano-3-pyridinyl)cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[2-(4-methylpiperazin-1-yl)-4-pyridinyl]cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclohexane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclopropane-1-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide is CN1CCN(c2cc(NC(=O)C3(c4ccc(-c5cnc(N)nc5)cc4)CCC3)ccn2)CC1.Cc1nc(-c2ccc(NC(=O)C3(c4ccc(-c5cnc(N)nc5)cc4)CC3)nc2)cs1.Cc1nc(-c2ccc(NC(=O)C3(c4ccc(-c5cnc(N)nc5)cc4)CCCCC3)nc2)cs1.Cc1nc(-c2ccc(NC(=O)C3(c4ccc(-c5cnc(N)nc5)cc4)CCOCC3)nc2)cs1.N#Cc1ccc(NC(=O)C2(c3ccc(-c4cnc(N)nc4)cc3)CCC2)cn1.
What is the InChIKey of 1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(6-cyano-3-pyridinyl)cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[2-(4-methylpiperazin-1-yl)-4-pyridinyl]cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclohexane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclopropane-1-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide?
The InChIKey is LXDLXVWWANHEBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N6OS.C25H29N7O.C25H24N6O2S.C23H20N6OS.C21H18N6O/c1-17-31-22(16-34-17)19-7-10-23(28-13-19)32-24(33)26(11-3-2-4-12-26)21-8-5-18(6-9-21)20-14-29-25(27)30-15-20;1-31-11-13-32(14-12-31)22-15-21(7-10-27-22)30-23(33)25(8-2-9-25)20-5-3-18(4-6-20)19-16-28-24(26)29-17-19;1-16-30-21(15-34-16)18-4-7-22(27-12-18)31-23(32)25(8-10-33-11-9-25)20-5-2-17(3-6-20)19-13-28-24(26)29-14-19;1-14-28-19(13-31-14)16-4-7-20(25-10-16)29-21(30)23(8-9-23)18-5-2-15(3-6-18)17-11-26-22(24)27-12-17;22-10-17-6-7-18(13-24-17)27-19(28)21(8-1-9-21)16-4-2-14(3-5-16)15-11-25-20(23)26-12-15/h5-10,13-16H,2-4,11-12H2,1H3,(H2,27,29,30)(H,28,32,33);3-7,10,15-17H,2,8-9,11-14H2,1H3,(H2,26,28,29)(H,27,30,33);2-7,12-15H,8-11H2,1H3,(H2,26,28,29)(H,27,31,32);2-7,10-13H,8-9H2,1H3,(H2,24,26,27)(H,25,29,30);2-7,11-13H,1,8-9H2,(H,27,28)(H2,23,25,26).
What are the key properties of 1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(6-cyano-3-pyridinyl)cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[2-(4-methylpiperazin-1-yl)-4-pyridinyl]cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclohexane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclopropane-1-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide?
1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(6-cyano-3-pyridinyl)cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[2-(4-methylpiperazin-1-yl)-4-pyridinyl]cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclohexane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclopropane-1-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide has a molecular weight of 2185.67 g/mol, XLogP of 19.84, 24 rotatable bonds, 10 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(6-cyano-3-pyridinyl)cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[2-(4-methylpiperazin-1-yl)-4-pyridinyl]cyclobutane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclohexane-1-carboxamide;1-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]cyclopropane-1-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide is sourced from PubChem (CID 159482284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).