2-(3-acetamidoanilino)-4-(piperidin-4-ylmethylamino)pyrimidine-5-carboxamide;N-(3-aminophenyl)acetamide;tert-butyl 4-[[[2-(3-acetamidoanilino)-5-carbamoylpyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate;tert-butyl 4-(aminomethyl)piperidine-1-carboxylate;tert-butyl 4-[[(5-carbamoyl-2-methylpyrimidin-4-yl)amino]methyl]piperidine-1-carboxylate;2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylic acid;ethyl 2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylate;ethyl 2,4-dichloropyrimidine-5-carboxylate;methane;oxolane

C126H189Cl4N33O23 — CID 159215477

IUPAC2-(3-acetamidoanilino)-4-(piperidin-4-ylmethylamino)pyrimidine-5-carboxamide;N-(3-aminophenyl)acetamide;tert-butyl 4-[[[2-(3-acetamidoanilino)-5-carbamoylpyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate;tert-butyl 4-(aminomethyl)piperidine-1-carboxylate;tert-butyl 4-[[(5-carbamoyl-2-methylpyrimidin-4-yl)amino]methyl]piperidine-1-carboxylate;2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylic acid;ethyl 2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylate;ethyl 2,4-dichloropyrimidine-5-carboxylate;methane;oxolane
SMILESC.C.C1CCOC1.CC(=O)Nc1cccc(N)c1.CC(=O)Nc1cccc(Nc2ncc(C(N)=O)c(NCC3CCN(C(=O)OC(C)(C)C)CC3)n2)c1.CC(=O)Nc1cccc(Nc2ncc(C(N)=O)c(NCC3CCNCC3)n2)c1.CC(C)(C)OC(=O)N1CCC(CN)CC1.CC(C)(C)OC(=O)N1CCC(CNc2nc(Cl)ncc2C(=O)O)CC1.CCOC(=O)c1cnc(Cl)nc1Cl.CCOC(=O)c1cnc(Cl)nc1NCC1CCN(C(=O)OC(C)(C)C)CC1.Cc1ncc(C(N)=O)c(NCC2CCN(C(=O)OC(C)(C)C)CC2)n1
InChIInChI=1S/C24H33N7O4.C19H25N7O2.C18H27ClN4O4.C17H27N5O3.C16H23ClN4O4.C11H22N2O2.C8H10N2O.C7H6Cl2N2O2.C4H8O.2CH4/c1-15(32)28-17-6-5-7-18(12-17)29-22-27-14-19(20(25)33)21(30-22)26-13-16-8-10-31(11-9-16)23(34)35-24(2,3)4;1-12(27)24-14-3-2-4-15(9-14)25-19-23-11-16(17(20)28)18(26-19)22-10-13-5-7-21-8-6-13;1-5-26-15(24)13-11-21-16(19)22-14(13)20-10-12-6-8-23(9-7-12)17(25)27-18(2,3)4;1-11-19-10-13(14(18)23)15(21-11)20-9-12-5-7-22(8-6-12)16(24)25-17(2,3)4;1-16(2,3)25-15(24)21-6-4-10(5-7-21)8-18-12-11(13(22)23)9-19-14(17)20-12;1-11(2,3)15-10(14)13-6-4-9(8-12)5-7-13;1-6(11)10-8-4-2-3-7(9)5-8;1-2-13-6(12)4-3-10-7(9)11-5(4)8;1-2-4-5-3-1;;/h5-7,12,14,16H,8-11,13H2,1-4H3,(H2,25,33)(H,28,32)(H2,26,27,29,30);2-4,9,11,13,21H,5-8,10H2,1H3,(H2,20,28)(H,24,27)(H2,22,23,25,26);11-12H,5-10H2,1-4H3,(H,20,21,22);10,12H,5-9H2,1-4H3,(H2,18,23)(H,19,20,21);9-10H,4-8H2,1-3H3,(H,22,23)(H,18,19,20);9H,4-8,12H2,1-3H3;2-5H,9H2,1H3,(H,10,11);3H,2H2,1H3;1-4H2;2*1H4
InChIKeyKQZWWMLLHCVXHS-UHFFFAOYSA-N
MW2675.92 g/mol
LogP20.07
Rot. Bonds31

About 2-(3-acetamidoanilino)-4-(piperidin-4-ylmethylamino)pyrimidine-5-carboxamide;N-(3-aminophenyl)acetamide;tert-butyl 4-[[[2-(3-acetamidoanilino)-5-carbamoylpyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate;tert-butyl 4-(aminomethyl)piperidine-1-carboxylate;tert-butyl 4-[[(5-carbamoyl-2-methylpyrimidin-4-yl)amino]methyl]piperidine-1-carboxylate;2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylic acid;ethyl 2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylate;ethyl 2,4-dichloropyrimidine-5-carboxylate;methane;oxolane

2-(3-acetamidoanilino)-4-(piperidin-4-ylmethylamino)pyrimidine-5-carboxamide;N-(3-aminophenyl)acetamide;tert-butyl 4-[[[2-(3-acetamidoanilino)-5-carbamoylpyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate;tert-butyl 4-(aminomethyl)piperidine-1-carboxylate;tert-butyl 4-[[(5-carbamoyl-2-methylpyrimidin-4-yl)amino]methyl]piperidine-1-carboxylate;2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylic acid;ethyl 2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylate;ethyl 2,4-dichloropyrimidine-5-carboxylate;methane;oxolane (PubChem CID 159215477) has the molecular formula C126H189Cl4N33O23 and a molecular weight of 2675.92 g/mol. Its IUPAC name is 2-(3-acetamidoanilino)-4-(piperidin-4-ylmethylamino)pyrimidine-5-carboxamide;N-(3-aminophenyl)acetamide;tert-butyl 4-[[[2-(3-acetamidoanilino)-5-carbamoylpyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate;tert-butyl 4-(aminomethyl)piperidine-1-carboxylate;tert-butyl 4-[[(5-carbamoyl-2-methylpyrimidin-4-yl)amino]methyl]piperidine-1-carboxylate;2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylic acid;ethyl 2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylate;ethyl 2,4-dichloropyrimidine-5-carboxylate;methane;oxolane.

Molecular Properties

Compound Name2-(3-acetamidoanilino)-4-(piperidin-4-ylmethylamino)pyrimidine-5-carboxamide;N-(3-aminophenyl)acetamide;tert-butyl 4-[[[2-(3-acetamidoanilino)-5-carbamoylpyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate;tert-butyl 4-(aminomethyl)piperidine-1-carboxylate;tert-butyl 4-[[(5-carbamoyl-2-methylpyrimidin-4-yl)amino]methyl]piperidine-1-carboxylate;2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylic acid;ethyl 2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylate;ethyl 2,4-dichloropyrimidine-5-carboxylate;methane;oxolane
PubChem CID159215477
Molecular FormulaC126H189Cl4N33O23
Molecular Weight2675.92 g/mol
Exact Mass2672.34
IUPAC Name2-(3-acetamidoanilino)-4-(piperidin-4-ylmethylamino)pyrimidine-5-carboxamide;N-(3-aminophenyl)acetamide;tert-butyl 4-[[[2-(3-acetamidoanilino)-5-carbamoylpyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate;tert-butyl 4-(aminomethyl)piperidine-1-carboxylate;tert-butyl 4-[[(5-carbamoyl-2-methylpyrimidin-4-yl)amino]methyl]piperidine-1-carboxylate;2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylic acid;ethyl 2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylate;ethyl 2,4-dichloropyrimidine-5-carboxylate;methane;oxolane
SMILESC.C.C1CCOC1.CC(=O)Nc1cccc(N)c1.CC(=O)Nc1cccc(Nc2ncc(C(N)=O)c(NCC3CCN(C(=O)OC(C)(C)C)CC3)n2)c1.CC(=O)Nc1cccc(Nc2ncc(C(N)=O)c(NCC3CCNCC3)n2)c1.CC(C)(C)OC(=O)N1CCC(CN)CC1.CC(C)(C)OC(=O)N1CCC(CNc2nc(Cl)ncc2C(=O)O)CC1.CCOC(=O)c1cnc(Cl)nc1Cl.CCOC(=O)c1cnc(Cl)nc1NCC1CCN(C(=O)OC(C)(C)C)CC1.Cc1ncc(C(N)=O)c(NCC2CCN(C(=O)OC(C)(C)C)CC2)n1
InChIInChI=1S/C24H33N7O4.C19H25N7O2.C18H27ClN4O4.C17H27N5O3.C16H23ClN4O4.C11H22N2O2.C8H10N2O.C7H6Cl2N2O2.C4H8O.2CH4/c1-15(32)28-17-6-5-7-18(12-17)29-22-27-14-19(20(25)33)21(30-22)26-13-16-8-10-31(11-9-16)23(34)35-24(2,3)4;1-12(27)24-14-3-2-4-15(9-14)25-19-23-11-16(17(20)28)18(26-19)22-10-13-5-7-21-8-6-13;1-5-26-15(24)13-11-21-16(19)22-14(13)20-10-12-6-8-23(9-7-12)17(25)27-18(2,3)4;1-11-19-10-13(14(18)23)15(21-11)20-9-12-5-7-22(8-6-12)16(24)25-17(2,3)4;1-16(2,3)25-15(24)21-6-4-10(5-7-21)8-18-12-11(13(22)23)9-19-14(17)20-12;1-11(2,3)15-10(14)13-6-4-9(8-12)5-7-13;1-6(11)10-8-4-2-3-7(9)5-8;1-2-13-6(12)4-3-10-7(9)11-5(4)8;1-2-4-5-3-1;;/h5-7,12,14,16H,8-11,13H2,1-4H3,(H2,25,33)(H,28,32)(H2,26,27,29,30);2-4,9,11,13,21H,5-8,10H2,1H3,(H2,20,28)(H,24,27)(H2,22,23,25,26);11-12H,5-10H2,1-4H3,(H,20,21,22);10,12H,5-9H2,1-4H3,(H2,18,23)(H,19,20,21);9-10H,4-8H2,1-3H3,(H,22,23)(H,18,19,20);9H,4-8,12H2,1-3H3;2-5H,9H2,1H3,(H,10,11);3H,2H2,1H3;1-4H2;2*1H4
InChIKeyKQZWWMLLHCVXHS-UHFFFAOYSA-N
XLogP20.07
TPSA766.36 Ų
H-Bond Donors17
H-Bond Acceptors44
Rotatable Bonds31
Heavy Atoms186
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002675.92
LogP ≤ 520.07
H-Bond Donors ≤ 517
H-Bond Acceptors ≤ 1044

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 2-(3-acetamidoanilino)-4-(piperidin-4-ylmethylamino)pyrimidine-5-carboxamide;N-(3-aminophenyl)acetamide;tert-butyl 4-[[[2-(3-acetamidoanilino)-5-carbamoylpyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate;tert-butyl 4-(aminomethyl)piperidine-1-carboxylate;tert-butyl 4-[[(5-carbamoyl-2-methylpyrimidin-4-yl)amino]methyl]piperidine-1-carboxylate;2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylic acid;ethyl 2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylate;ethyl 2,4-dichloropyrimidine-5-carboxylate;methane;oxolane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(3-acetamidoanilino)-4-(piperidin-4-ylmethylamino)pyrimidine-5-carboxamide;N-(3-aminophenyl)acetamide;tert-butyl 4-[[[2-(3-acetamidoanilino)-5-carbamoylpyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate;tert-butyl 4-(aminomethyl)piperidine-1-carboxylate;tert-butyl 4-[[(5-carbamoyl-2-methylpyrimidin-4-yl)amino]methyl]piperidine-1-carboxylate;2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylic acid;ethyl 2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylate;ethyl 2,4-dichloropyrimidine-5-carboxylate;methane;oxolane?
The IUPAC name of 2-(3-acetamidoanilino)-4-(piperidin-4-ylmethylamino)pyrimidine-5-carboxamide;N-(3-aminophenyl)acetamide;tert-butyl 4-[[[2-(3-acetamidoanilino)-5-carbamoylpyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate;tert-butyl 4-(aminomethyl)piperidine-1-carboxylate;tert-butyl 4-[[(5-carbamoyl-2-methylpyrimidin-4-yl)amino]methyl]piperidine-1-carboxylate;2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylic acid;ethyl 2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylate;ethyl 2,4-dichloropyrimidine-5-carboxylate;methane;oxolane (CID 159215477) is 2-(3-acetamidoanilino)-4-(piperidin-4-ylmethylamino)pyrimidine-5-carboxamide;N-(3-aminophenyl)acetamide;tert-butyl 4-[[[2-(3-acetamidoanilino)-5-carbamoylpyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate;tert-butyl 4-(aminomethyl)piperidine-1-carboxylate;tert-butyl 4-[[(5-carbamoyl-2-methylpyrimidin-4-yl)amino]methyl]piperidine-1-carboxylate;2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylic acid;ethyl 2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylate;ethyl 2,4-dichloropyrimidine-5-carboxylate;methane;oxolane.
What is the SMILES notation for 2-(3-acetamidoanilino)-4-(piperidin-4-ylmethylamino)pyrimidine-5-carboxamide;N-(3-aminophenyl)acetamide;tert-butyl 4-[[[2-(3-acetamidoanilino)-5-carbamoylpyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate;tert-butyl 4-(aminomethyl)piperidine-1-carboxylate;tert-butyl 4-[[(5-carbamoyl-2-methylpyrimidin-4-yl)amino]methyl]piperidine-1-carboxylate;2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylic acid;ethyl 2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylate;ethyl 2,4-dichloropyrimidine-5-carboxylate;methane;oxolane?
The canonical SMILES for 2-(3-acetamidoanilino)-4-(piperidin-4-ylmethylamino)pyrimidine-5-carboxamide;N-(3-aminophenyl)acetamide;tert-butyl 4-[[[2-(3-acetamidoanilino)-5-carbamoylpyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate;tert-butyl 4-(aminomethyl)piperidine-1-carboxylate;tert-butyl 4-[[(5-carbamoyl-2-methylpyrimidin-4-yl)amino]methyl]piperidine-1-carboxylate;2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylic acid;ethyl 2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylate;ethyl 2,4-dichloropyrimidine-5-carboxylate;methane;oxolane is C.C.C1CCOC1.CC(=O)Nc1cccc(N)c1.CC(=O)Nc1cccc(Nc2ncc(C(N)=O)c(NCC3CCN(C(=O)OC(C)(C)C)CC3)n2)c1.CC(=O)Nc1cccc(Nc2ncc(C(N)=O)c(NCC3CCNCC3)n2)c1.CC(C)(C)OC(=O)N1CCC(CN)CC1.CC(C)(C)OC(=O)N1CCC(CNc2nc(Cl)ncc2C(=O)O)CC1.CCOC(=O)c1cnc(Cl)nc1Cl.CCOC(=O)c1cnc(Cl)nc1NCC1CCN(C(=O)OC(C)(C)C)CC1.Cc1ncc(C(N)=O)c(NCC2CCN(C(=O)OC(C)(C)C)CC2)n1.
What is the InChIKey of 2-(3-acetamidoanilino)-4-(piperidin-4-ylmethylamino)pyrimidine-5-carboxamide;N-(3-aminophenyl)acetamide;tert-butyl 4-[[[2-(3-acetamidoanilino)-5-carbamoylpyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate;tert-butyl 4-(aminomethyl)piperidine-1-carboxylate;tert-butyl 4-[[(5-carbamoyl-2-methylpyrimidin-4-yl)amino]methyl]piperidine-1-carboxylate;2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylic acid;ethyl 2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylate;ethyl 2,4-dichloropyrimidine-5-carboxylate;methane;oxolane?
The InChIKey is KQZWWMLLHCVXHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33N7O4.C19H25N7O2.C18H27ClN4O4.C17H27N5O3.C16H23ClN4O4.C11H22N2O2.C8H10N2O.C7H6Cl2N2O2.C4H8O.2CH4/c1-15(32)28-17-6-5-7-18(12-17)29-22-27-14-19(20(25)33)21(30-22)26-13-16-8-10-31(11-9-16)23(34)35-24(2,3)4;1-12(27)24-14-3-2-4-15(9-14)25-19-23-11-16(17(20)28)18(26-19)22-10-13-5-7-21-8-6-13;1-5-26-15(24)13-11-21-16(19)22-14(13)20-10-12-6-8-23(9-7-12)17(25)27-18(2,3)4;1-11-19-10-13(14(18)23)15(21-11)20-9-12-5-7-22(8-6-12)16(24)25-17(2,3)4;1-16(2,3)25-15(24)21-6-4-10(5-7-21)8-18-12-11(13(22)23)9-19-14(17)20-12;1-11(2,3)15-10(14)13-6-4-9(8-12)5-7-13;1-6(11)10-8-4-2-3-7(9)5-8;1-2-13-6(12)4-3-10-7(9)11-5(4)8;1-2-4-5-3-1;;/h5-7,12,14,16H,8-11,13H2,1-4H3,(H2,25,33)(H,28,32)(H2,26,27,29,30);2-4,9,11,13,21H,5-8,10H2,1H3,(H2,20,28)(H,24,27)(H2,22,23,25,26);11-12H,5-10H2,1-4H3,(H,20,21,22);10,12H,5-9H2,1-4H3,(H2,18,23)(H,19,20,21);9-10H,4-8H2,1-3H3,(H,22,23)(H,18,19,20);9H,4-8,12H2,1-3H3;2-5H,9H2,1H3,(H,10,11);3H,2H2,1H3;1-4H2;2*1H4.
What are the key properties of 2-(3-acetamidoanilino)-4-(piperidin-4-ylmethylamino)pyrimidine-5-carboxamide;N-(3-aminophenyl)acetamide;tert-butyl 4-[[[2-(3-acetamidoanilino)-5-carbamoylpyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate;tert-butyl 4-(aminomethyl)piperidine-1-carboxylate;tert-butyl 4-[[(5-carbamoyl-2-methylpyrimidin-4-yl)amino]methyl]piperidine-1-carboxylate;2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylic acid;ethyl 2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylate;ethyl 2,4-dichloropyrimidine-5-carboxylate;methane;oxolane?
2-(3-acetamidoanilino)-4-(piperidin-4-ylmethylamino)pyrimidine-5-carboxamide;N-(3-aminophenyl)acetamide;tert-butyl 4-[[[2-(3-acetamidoanilino)-5-carbamoylpyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate;tert-butyl 4-(aminomethyl)piperidine-1-carboxylate;tert-butyl 4-[[(5-carbamoyl-2-methylpyrimidin-4-yl)amino]methyl]piperidine-1-carboxylate;2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylic acid;ethyl 2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylate;ethyl 2,4-dichloropyrimidine-5-carboxylate;methane;oxolane has a molecular weight of 2675.92 g/mol, XLogP of 20.07, 31 rotatable bonds, 17 hydrogen bond donors, and 44 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-acetamidoanilino)-4-(piperidin-4-ylmethylamino)pyrimidine-5-carboxamide;N-(3-aminophenyl)acetamide;tert-butyl 4-[[[2-(3-acetamidoanilino)-5-carbamoylpyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate;tert-butyl 4-(aminomethyl)piperidine-1-carboxylate;tert-butyl 4-[[(5-carbamoyl-2-methylpyrimidin-4-yl)amino]methyl]piperidine-1-carboxylate;2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylic acid;ethyl 2-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]pyrimidine-5-carboxylate;ethyl 2,4-dichloropyrimidine-5-carboxylate;methane;oxolane is sourced from PubChem (CID 159215477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).