4-[4-(aminomethyl)phenyl]-N-(4-morpholin-4-ylphenyl)pyrimidin-2-amine;N-[4-[2-[4-[bis(2-methoxyethyl)amino]anilino]pyrimidin-4-yl]phenyl]acetamide;6-methoxy-N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]pyridine-3-carboxamide;methyl 4-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]anilino]-4-oxobutanoate;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]butanamide;N-[[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]methyl]acetamide;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]-3-pyridin-3-ylpropanamide;N-[4-[2-(4-morpholin-4-ylsulfonylanilino)pyrimidin-4-yl]phenyl]acetamide

C194H208N42O21S — CID 157375834

IUPAC4-[4-(aminomethyl)phenyl]-N-(4-morpholin-4-ylphenyl)pyrimidin-2-amine;N-[4-[2-[4-[bis(2-methoxyethyl)amino]anilino]pyrimidin-4-yl]phenyl]acetamide;6-methoxy-N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]pyridine-3-carboxamide;methyl 4-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]anilino]-4-oxobutanoate;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]butanamide;N-[[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]methyl]acetamide;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]-3-pyridin-3-ylpropanamide;N-[4-[2-(4-morpholin-4-ylsulfonylanilino)pyrimidin-4-yl]phenyl]acetamide
SMILESCC(=O)NCc1ccc(-c2ccnc(Nc3ccc(N4CCOCC4)cc3)n2)cc1.CC(=O)Nc1ccc(-c2ccnc(Nc3ccc(S(=O)(=O)N4CCOCC4)cc3)n2)cc1.CCCC(=O)Nc1ccc(-c2ccnc(Nc3ccc(N4CCOCC4)cc3)n2)cc1.COC(=O)CCC(=O)Nc1ccc(-c2ccnc(Nc3ccc(N4CCOCC4)cc3)n2)cc1.COCCN(CCOC)c1ccc(Nc2nccc(-c3ccc(NC(C)=O)cc3)n2)cc1.COc1ccc(C(=O)Nc2ccc(-c3ccnc(Nc4ccc(N5CCOCC5)cc4)n3)cc2)cn1.NCc1ccc(-c2ccnc(Nc3ccc(N4CCOCC4)cc3)n2)cc1.O=C(CCc1cccnc1)Nc1ccc(-c2ccnc(Nc3ccc(N4CCOCC4)cc3)n2)cc1
InChIInChI=1S/C28H28N6O2.C27H26N6O3.C25H27N5O4.C24H29N5O3.C24H27N5O2.C23H25N5O2.C22H23N5O4S.C21H23N5O/c35-27(12-3-21-2-1-14-29-20-21)31-23-6-4-22(5-7-23)26-13-15-30-28(33-26)32-24-8-10-25(11-9-24)34-16-18-36-19-17-34;1-35-25-11-4-20(18-29-25)26(34)30-21-5-2-19(3-6-21)24-12-13-28-27(32-24)31-22-7-9-23(10-8-22)33-14-16-36-17-15-33;1-33-24(32)11-10-23(31)27-19-4-2-18(3-5-19)22-12-13-26-25(29-22)28-20-6-8-21(9-7-20)30-14-16-34-17-15-30;1-18(30)26-20-6-4-19(5-7-20)23-12-13-25-24(28-23)27-21-8-10-22(11-9-21)29(14-16-31-2)15-17-32-3;1-2-3-23(30)26-19-6-4-18(5-7-19)22-12-13-25-24(28-22)27-20-8-10-21(11-9-20)29-14-16-31-17-15-29;1-17(29)25-16-18-2-4-19(5-3-18)22-10-11-24-23(27-22)26-20-6-8-21(9-7-20)28-12-14-30-15-13-28;1-16(28)24-18-4-2-17(3-5-18)21-10-11-23-22(26-21)25-19-6-8-20(9-7-19)32(29,30)27-12-14-31-15-13-27;22-15-16-1-3-17(4-2-16)20-9-10-23-21(25-20)24-18-5-7-19(8-6-18)26-11-13-27-14-12-26/h1-2,4-11,13-15,20H,3,12,16-19H2,(H,31,35)(H,30,32,33);2-13,18H,14-17H2,1H3,(H,30,34)(H,28,31,32);2-9,12-13H,10-11,14-17H2,1H3,(H,27,31)(H,26,28,29);4-13H,14-17H2,1-3H3,(H,26,30)(H,25,27,28);4-13H,2-3,14-17H2,1H3,(H,26,30)(H,25,27,28);2-11H,12-16H2,1H3,(H,25,29)(H,24,26,27);2-11H,12-15H2,1H3,(H,24,28)(H,23,25,26);1-10H,11-15,22H2,(H,23,24,25)
InChIKeyBKHWQBHHHPIGAA-UHFFFAOYSA-N
MW3496.14 g/mol
LogP30.50
Rot. Bonds58

About 4-[4-(aminomethyl)phenyl]-N-(4-morpholin-4-ylphenyl)pyrimidin-2-amine;N-[4-[2-[4-[bis(2-methoxyethyl)amino]anilino]pyrimidin-4-yl]phenyl]acetamide;6-methoxy-N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]pyridine-3-carboxamide;methyl 4-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]anilino]-4-oxobutanoate;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]butanamide;N-[[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]methyl]acetamide;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]-3-pyridin-3-ylpropanamide;N-[4-[2-(4-morpholin-4-ylsulfonylanilino)pyrimidin-4-yl]phenyl]acetamide

4-[4-(aminomethyl)phenyl]-N-(4-morpholin-4-ylphenyl)pyrimidin-2-amine;N-[4-[2-[4-[bis(2-methoxyethyl)amino]anilino]pyrimidin-4-yl]phenyl]acetamide;6-methoxy-N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]pyridine-3-carboxamide;methyl 4-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]anilino]-4-oxobutanoate;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]butanamide;N-[[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]methyl]acetamide;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]-3-pyridin-3-ylpropanamide;N-[4-[2-(4-morpholin-4-ylsulfonylanilino)pyrimidin-4-yl]phenyl]acetamide (PubChem CID 157375834) has the molecular formula C194H208N42O21S and a molecular weight of 3496.14 g/mol. Its IUPAC name is 4-[4-(aminomethyl)phenyl]-N-(4-morpholin-4-ylphenyl)pyrimidin-2-amine;N-[4-[2-[4-[bis(2-methoxyethyl)amino]anilino]pyrimidin-4-yl]phenyl]acetamide;6-methoxy-N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]pyridine-3-carboxamide;methyl 4-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]anilino]-4-oxobutanoate;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]butanamide;N-[[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]methyl]acetamide;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]-3-pyridin-3-ylpropanamide;N-[4-[2-(4-morpholin-4-ylsulfonylanilino)pyrimidin-4-yl]phenyl]acetamide.

Molecular Properties

Compound Name4-[4-(aminomethyl)phenyl]-N-(4-morpholin-4-ylphenyl)pyrimidin-2-amine;N-[4-[2-[4-[bis(2-methoxyethyl)amino]anilino]pyrimidin-4-yl]phenyl]acetamide;6-methoxy-N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]pyridine-3-carboxamide;methyl 4-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]anilino]-4-oxobutanoate;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]butanamide;N-[[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]methyl]acetamide;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]-3-pyridin-3-ylpropanamide;N-[4-[2-(4-morpholin-4-ylsulfonylanilino)pyrimidin-4-yl]phenyl]acetamide
PubChem CID157375834
Molecular FormulaC194H208N42O21S
Molecular Weight3496.14 g/mol
Exact Mass3493.62
IUPAC Name4-[4-(aminomethyl)phenyl]-N-(4-morpholin-4-ylphenyl)pyrimidin-2-amine;N-[4-[2-[4-[bis(2-methoxyethyl)amino]anilino]pyrimidin-4-yl]phenyl]acetamide;6-methoxy-N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]pyridine-3-carboxamide;methyl 4-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]anilino]-4-oxobutanoate;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]butanamide;N-[[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]methyl]acetamide;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]-3-pyridin-3-ylpropanamide;N-[4-[2-(4-morpholin-4-ylsulfonylanilino)pyrimidin-4-yl]phenyl]acetamide
SMILESCC(=O)NCc1ccc(-c2ccnc(Nc3ccc(N4CCOCC4)cc3)n2)cc1.CC(=O)Nc1ccc(-c2ccnc(Nc3ccc(S(=O)(=O)N4CCOCC4)cc3)n2)cc1.CCCC(=O)Nc1ccc(-c2ccnc(Nc3ccc(N4CCOCC4)cc3)n2)cc1.COC(=O)CCC(=O)Nc1ccc(-c2ccnc(Nc3ccc(N4CCOCC4)cc3)n2)cc1.COCCN(CCOC)c1ccc(Nc2nccc(-c3ccc(NC(C)=O)cc3)n2)cc1.COc1ccc(C(=O)Nc2ccc(-c3ccnc(Nc4ccc(N5CCOCC5)cc4)n3)cc2)cn1.NCc1ccc(-c2ccnc(Nc3ccc(N4CCOCC4)cc3)n2)cc1.O=C(CCc1cccnc1)Nc1ccc(-c2ccnc(Nc3ccc(N4CCOCC4)cc3)n2)cc1
InChIInChI=1S/C28H28N6O2.C27H26N6O3.C25H27N5O4.C24H29N5O3.C24H27N5O2.C23H25N5O2.C22H23N5O4S.C21H23N5O/c35-27(12-3-21-2-1-14-29-20-21)31-23-6-4-22(5-7-23)26-13-15-30-28(33-26)32-24-8-10-25(11-9-24)34-16-18-36-19-17-34;1-35-25-11-4-20(18-29-25)26(34)30-21-5-2-19(3-6-21)24-12-13-28-27(32-24)31-22-7-9-23(10-8-22)33-14-16-36-17-15-33;1-33-24(32)11-10-23(31)27-19-4-2-18(3-5-19)22-12-13-26-25(29-22)28-20-6-8-21(9-7-20)30-14-16-34-17-15-30;1-18(30)26-20-6-4-19(5-7-20)23-12-13-25-24(28-23)27-21-8-10-22(11-9-21)29(14-16-31-2)15-17-32-3;1-2-3-23(30)26-19-6-4-18(5-7-19)22-12-13-25-24(28-22)27-20-8-10-21(11-9-20)29-14-16-31-17-15-29;1-17(29)25-16-18-2-4-19(5-3-18)22-10-11-24-23(27-22)26-20-6-8-21(9-7-20)28-12-14-30-15-13-28;1-16(28)24-18-4-2-17(3-5-18)21-10-11-23-22(26-21)25-19-6-8-20(9-7-19)32(29,30)27-12-14-31-15-13-27;22-15-16-1-3-17(4-2-16)20-9-10-23-21(25-20)24-18-5-7-19(8-6-18)26-11-13-27-14-12-26/h1-2,4-11,13-15,20H,3,12,16-19H2,(H,31,35)(H,30,32,33);2-13,18H,14-17H2,1H3,(H,30,34)(H,28,31,32);2-9,12-13H,10-11,14-17H2,1H3,(H,27,31)(H,26,28,29);4-13H,14-17H2,1-3H3,(H,26,30)(H,25,27,28);4-13H,2-3,14-17H2,1H3,(H,26,30)(H,25,27,28);2-11H,12-16H2,1H3,(H,25,29)(H,24,26,27);2-11H,12-15H2,1H3,(H,24,28)(H,23,25,26);1-10H,11-15,22H2,(H,23,24,25)
InChIKeyBKHWQBHHHPIGAA-UHFFFAOYSA-N
XLogP30.50
TPSA736.64 Ų
H-Bond Donors16
H-Bond Acceptors55
Rotatable Bonds58
Heavy Atoms258
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003496.14
LogP ≤ 530.50
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1055

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

Analyze 4-[4-(aminomethyl)phenyl]-N-(4-morpholin-4-ylphenyl)pyrimidin-2-amine;N-[4-[2-[4-[bis(2-methoxyethyl)amino]anilino]pyrimidin-4-yl]phenyl]acetamide;6-methoxy-N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]pyridine-3-carboxamide;methyl 4-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]anilino]-4-oxobutanoate;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]butanamide;N-[[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]methyl]acetamide;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]-3-pyridin-3-ylpropanamide;N-[4-[2-(4-morpholin-4-ylsulfonylanilino)pyrimidin-4-yl]phenyl]acetamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(aminomethyl)phenyl]-N-(4-morpholin-4-ylphenyl)pyrimidin-2-amine;N-[4-[2-[4-[bis(2-methoxyethyl)amino]anilino]pyrimidin-4-yl]phenyl]acetamide;6-methoxy-N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]pyridine-3-carboxamide;methyl 4-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]anilino]-4-oxobutanoate;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]butanamide;N-[[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]methyl]acetamide;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]-3-pyridin-3-ylpropanamide;N-[4-[2-(4-morpholin-4-ylsulfonylanilino)pyrimidin-4-yl]phenyl]acetamide?
The IUPAC name of 4-[4-(aminomethyl)phenyl]-N-(4-morpholin-4-ylphenyl)pyrimidin-2-amine;N-[4-[2-[4-[bis(2-methoxyethyl)amino]anilino]pyrimidin-4-yl]phenyl]acetamide;6-methoxy-N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]pyridine-3-carboxamide;methyl 4-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]anilino]-4-oxobutanoate;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]butanamide;N-[[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]methyl]acetamide;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]-3-pyridin-3-ylpropanamide;N-[4-[2-(4-morpholin-4-ylsulfonylanilino)pyrimidin-4-yl]phenyl]acetamide (CID 157375834) is 4-[4-(aminomethyl)phenyl]-N-(4-morpholin-4-ylphenyl)pyrimidin-2-amine;N-[4-[2-[4-[bis(2-methoxyethyl)amino]anilino]pyrimidin-4-yl]phenyl]acetamide;6-methoxy-N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]pyridine-3-carboxamide;methyl 4-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]anilino]-4-oxobutanoate;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]butanamide;N-[[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]methyl]acetamide;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]-3-pyridin-3-ylpropanamide;N-[4-[2-(4-morpholin-4-ylsulfonylanilino)pyrimidin-4-yl]phenyl]acetamide.
What is the SMILES notation for 4-[4-(aminomethyl)phenyl]-N-(4-morpholin-4-ylphenyl)pyrimidin-2-amine;N-[4-[2-[4-[bis(2-methoxyethyl)amino]anilino]pyrimidin-4-yl]phenyl]acetamide;6-methoxy-N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]pyridine-3-carboxamide;methyl 4-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]anilino]-4-oxobutanoate;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]butanamide;N-[[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]methyl]acetamide;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]-3-pyridin-3-ylpropanamide;N-[4-[2-(4-morpholin-4-ylsulfonylanilino)pyrimidin-4-yl]phenyl]acetamide?
The canonical SMILES for 4-[4-(aminomethyl)phenyl]-N-(4-morpholin-4-ylphenyl)pyrimidin-2-amine;N-[4-[2-[4-[bis(2-methoxyethyl)amino]anilino]pyrimidin-4-yl]phenyl]acetamide;6-methoxy-N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]pyridine-3-carboxamide;methyl 4-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]anilino]-4-oxobutanoate;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]butanamide;N-[[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]methyl]acetamide;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]-3-pyridin-3-ylpropanamide;N-[4-[2-(4-morpholin-4-ylsulfonylanilino)pyrimidin-4-yl]phenyl]acetamide is CC(=O)NCc1ccc(-c2ccnc(Nc3ccc(N4CCOCC4)cc3)n2)cc1.CC(=O)Nc1ccc(-c2ccnc(Nc3ccc(S(=O)(=O)N4CCOCC4)cc3)n2)cc1.CCCC(=O)Nc1ccc(-c2ccnc(Nc3ccc(N4CCOCC4)cc3)n2)cc1.COC(=O)CCC(=O)Nc1ccc(-c2ccnc(Nc3ccc(N4CCOCC4)cc3)n2)cc1.COCCN(CCOC)c1ccc(Nc2nccc(-c3ccc(NC(C)=O)cc3)n2)cc1.COc1ccc(C(=O)Nc2ccc(-c3ccnc(Nc4ccc(N5CCOCC5)cc4)n3)cc2)cn1.NCc1ccc(-c2ccnc(Nc3ccc(N4CCOCC4)cc3)n2)cc1.O=C(CCc1cccnc1)Nc1ccc(-c2ccnc(Nc3ccc(N4CCOCC4)cc3)n2)cc1.
What is the InChIKey of 4-[4-(aminomethyl)phenyl]-N-(4-morpholin-4-ylphenyl)pyrimidin-2-amine;N-[4-[2-[4-[bis(2-methoxyethyl)amino]anilino]pyrimidin-4-yl]phenyl]acetamide;6-methoxy-N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]pyridine-3-carboxamide;methyl 4-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]anilino]-4-oxobutanoate;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]butanamide;N-[[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]methyl]acetamide;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]-3-pyridin-3-ylpropanamide;N-[4-[2-(4-morpholin-4-ylsulfonylanilino)pyrimidin-4-yl]phenyl]acetamide?
The InChIKey is BKHWQBHHHPIGAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H28N6O2.C27H26N6O3.C25H27N5O4.C24H29N5O3.C24H27N5O2.C23H25N5O2.C22H23N5O4S.C21H23N5O/c35-27(12-3-21-2-1-14-29-20-21)31-23-6-4-22(5-7-23)26-13-15-30-28(33-26)32-24-8-10-25(11-9-24)34-16-18-36-19-17-34;1-35-25-11-4-20(18-29-25)26(34)30-21-5-2-19(3-6-21)24-12-13-28-27(32-24)31-22-7-9-23(10-8-22)33-14-16-36-17-15-33;1-33-24(32)11-10-23(31)27-19-4-2-18(3-5-19)22-12-13-26-25(29-22)28-20-6-8-21(9-7-20)30-14-16-34-17-15-30;1-18(30)26-20-6-4-19(5-7-20)23-12-13-25-24(28-23)27-21-8-10-22(11-9-21)29(14-16-31-2)15-17-32-3;1-2-3-23(30)26-19-6-4-18(5-7-19)22-12-13-25-24(28-22)27-20-8-10-21(11-9-20)29-14-16-31-17-15-29;1-17(29)25-16-18-2-4-19(5-3-18)22-10-11-24-23(27-22)26-20-6-8-21(9-7-20)28-12-14-30-15-13-28;1-16(28)24-18-4-2-17(3-5-18)21-10-11-23-22(26-21)25-19-6-8-20(9-7-19)32(29,30)27-12-14-31-15-13-27;22-15-16-1-3-17(4-2-16)20-9-10-23-21(25-20)24-18-5-7-19(8-6-18)26-11-13-27-14-12-26/h1-2,4-11,13-15,20H,3,12,16-19H2,(H,31,35)(H,30,32,33);2-13,18H,14-17H2,1H3,(H,30,34)(H,28,31,32);2-9,12-13H,10-11,14-17H2,1H3,(H,27,31)(H,26,28,29);4-13H,14-17H2,1-3H3,(H,26,30)(H,25,27,28);4-13H,2-3,14-17H2,1H3,(H,26,30)(H,25,27,28);2-11H,12-16H2,1H3,(H,25,29)(H,24,26,27);2-11H,12-15H2,1H3,(H,24,28)(H,23,25,26);1-10H,11-15,22H2,(H,23,24,25).
What are the key properties of 4-[4-(aminomethyl)phenyl]-N-(4-morpholin-4-ylphenyl)pyrimidin-2-amine;N-[4-[2-[4-[bis(2-methoxyethyl)amino]anilino]pyrimidin-4-yl]phenyl]acetamide;6-methoxy-N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]pyridine-3-carboxamide;methyl 4-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]anilino]-4-oxobutanoate;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]butanamide;N-[[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]methyl]acetamide;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]-3-pyridin-3-ylpropanamide;N-[4-[2-(4-morpholin-4-ylsulfonylanilino)pyrimidin-4-yl]phenyl]acetamide?
4-[4-(aminomethyl)phenyl]-N-(4-morpholin-4-ylphenyl)pyrimidin-2-amine;N-[4-[2-[4-[bis(2-methoxyethyl)amino]anilino]pyrimidin-4-yl]phenyl]acetamide;6-methoxy-N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]pyridine-3-carboxamide;methyl 4-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]anilino]-4-oxobutanoate;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]butanamide;N-[[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]methyl]acetamide;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]-3-pyridin-3-ylpropanamide;N-[4-[2-(4-morpholin-4-ylsulfonylanilino)pyrimidin-4-yl]phenyl]acetamide has a molecular weight of 3496.14 g/mol, XLogP of 30.50, 58 rotatable bonds, 16 hydrogen bond donors, and 55 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(aminomethyl)phenyl]-N-(4-morpholin-4-ylphenyl)pyrimidin-2-amine;N-[4-[2-[4-[bis(2-methoxyethyl)amino]anilino]pyrimidin-4-yl]phenyl]acetamide;6-methoxy-N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]pyridine-3-carboxamide;methyl 4-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]anilino]-4-oxobutanoate;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]butanamide;N-[[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]methyl]acetamide;N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]-3-pyridin-3-ylpropanamide;N-[4-[2-(4-morpholin-4-ylsulfonylanilino)pyrimidin-4-yl]phenyl]acetamide is sourced from PubChem (CID 157375834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).