tert-butyl N-ethyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;tert-butyl N-methyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;(E)-1-[(3R)-3-[[4-[(dimethylamino)methyl]triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[[4-(ethylaminomethyl)triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3S)-3-[(2-ethyl-1,3-oxazol-5-yl)methyl]piperidin-1-yl]-3-(1-methyltriazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,2-oxazol-3-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,3-oxazol-2-yl)prop-2-en-1-one;(E)-3-(1-methylpyrazol-4-yl)-1-[(3R)-3-[(4-propyltriazol-1-yl)methyl]piperidin-1-yl]prop-2-en-1-one

C150H217N49O15 — CID 157397405

About tert-butyl N-ethyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;tert-butyl N-methyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;(E)-1-[(3R)-3-[[4-[(dimethylamino)methyl]triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[[4-(ethylaminomethyl)triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3S)-3-[(2-ethyl-1,3-oxazol-5-yl)methyl]piperidin-1-yl]-3-(1-methyltriazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,2-oxazol-3-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,3-oxazol-2-yl)prop-2-en-1-one;(E)-3-(1-methylpyrazol-4-yl)-1-[(3R)-3-[(4-propyltriazol-1-yl)methyl]piperidin-1-yl]prop-2-en-1-one

tert-butyl N-ethyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;tert-butyl N-methyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;(E)-1-[(3R)-3-[[4-[(dimethylamino)methyl]triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[[4-(ethylaminomethyl)triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3S)-3-[(2-ethyl-1,3-oxazol-5-yl)methyl]piperidin-1-yl]-3-(1-methyltriazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,2-oxazol-3-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,3-oxazol-2-yl)prop-2-en-1-one;(E)-3-(1-methylpyrazol-4-yl)-1-[(3R)-3-[(4-propyltriazol-1-yl)methyl]piperidin-1-yl]prop-2-en-1-one (PubChem CID 157397405) has the molecular formula C150H217N49O15 and a molecular weight of 2946.71 g/mol. Its IUPAC name is tert-butyl N-ethyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;tert-butyl N-methyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;(E)-1-[(3R)-3-[[4-[(dimethylamino)methyl]triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[[4-(ethylaminomethyl)triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3S)-3-[(2-ethyl-1,3-oxazol-5-yl)methyl]piperidin-1-yl]-3-(1-methyltriazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,2-oxazol-3-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,3-oxazol-2-yl)prop-2-en-1-one;(E)-3-(1-methylpyrazol-4-yl)-1-[(3R)-3-[(4-propyltriazol-1-yl)methyl]piperidin-1-yl]prop-2-en-1-one.

Molecular Properties

• Compound Name: tert-butyl N-ethyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;tert-butyl N-methyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;(E)-1-[(3R)-3-[[4-[(dimethylamino)methyl]triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[[4-(ethylaminomethyl)triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3S)-3-[(2-ethyl-1,3-oxazol-5-yl)methyl]piperidin-1-yl]-3-(1-methyltriazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,2-oxazol-3-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,3-oxazol-2-yl)prop-2-en-1-one;(E)-3-(1-methylpyrazol-4-yl)-1-[(3R)-3-[(4-propyltriazol-1-yl)methyl]piperidin-1-yl]prop-2-en-1-one
• PubChem CID: 157397405
• Molecular Formula: C150H217N49O15
• Molecular Weight: 2946.71 g/mol
• Exact Mass: 2944.77
• IUPAC Name: tert-butyl N-ethyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;tert-butyl N-methyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;(E)-1-[(3R)-3-[[4-[(dimethylamino)methyl]triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[[4-(ethylaminomethyl)triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3S)-3-[(2-ethyl-1,3-oxazol-5-yl)methyl]piperidin-1-yl]-3-(1-methyltriazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,2-oxazol-3-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,3-oxazol-2-yl)prop-2-en-1-one;(E)-3-(1-methylpyrazol-4-yl)-1-[(3R)-3-[(4-propyltriazol-1-yl)methyl]piperidin-1-yl]prop-2-en-1-one
• SMILES: CCCc1cn(C[C@@H]2CCCN(C(=O)/C=C/c3cnn(C)c3)C2)nn1.CCN(Cc1cn(C[C@@H]2CCCN(C(=O)/C=C/c3cnn(C)c3)C2)nn1)C(=O)OC(C)(C)C.CCNCc1cn(C[C@@H]2CCCN(C(=O)/C=C/c3cnn(C)c3)C2)nn1.CCc1cn(C[C@@H]2CCCN(C(=O)/C=C/c3cc(C)on3)C2)nn1.CCc1cn(C[C@@H]2CCCN(C(=O)/C=C/c3ncc(C)o3)C2)nn1.CCc1ncc(C[C@@H]2CCCN(C(=O)/C=C/c3cn(C)nn3)C2)o1.CN(C)Cc1cn(C[C@@H]2CCCN(C(=O)/C=C/c3cnn(C)c3)C2)nn1.CN(Cc1cn(C[C@@H]2CCCN(C(=O)/C=C/c3cnn(C)c3)C2)nn1)C(=O)OC(C)(C)C
• InChI: InChI=1S/C23H35N7O3.C22H33N7O3.2C18H27N7O.C18H26N6O.3C17H23N5O2/c1-6-28(22(32)33-23(2,3)4)16-20-17-30(26-25-20)15-19-8-7-11-29(14-19)21(31)10-9-18-12-24-27(5)13-18;1-22(2,3)32-21(31)26(4)15-19-16-29(25-24-19)14-18-7-6-10-28(13-18)20(30)9-8-17-11-23-27(5)12-17;1-22(2)13-17-14-25(21-20-17)12-16-5-4-8-24(11-16)18(26)7-6-15-9-19-23(3)10-15;1-3-19-10-17-14-25(22-21-17)13-16-5-4-8-24(12-16)18(26)7-6-15-9-20-23(2)11-15;1-3-5-17-14-24(21-20-17)13-16-6-4-9-23(12-16)18(25)8-7-15-10-19-22(2)11-15;1-3-16-18-10-15(24-16)9-13-5-4-8-22(11-13)17(23)7-6-14-12-21(2)20-19-14;1-3-15-12-22(20-19-15)11-14-5-4-8-21(10-14)17(23)7-6-16-18-9-13(2)24-16;1-3-15-12-22(20-18-15)11-14-5-4-8-21(10-14)17(23)7-6-16-9-13(2)24-19-16/h9-10,12-13,17,19H,6-8,11,14-16H2,1-5H3;8-9,11-12,16,18H,6-7,10,13-15H2,1-5H3;6-7,9-10,14,16H,4-5,8,11-13H2,1-3H3;6-7,9,11,14,16,19H,3-5,8,10,12-13H2,1-2H3;7-8,10-11,14,16H,3-6,9,12-13H2,1-2H3;6-7,10,12-13H,3-5,8-9,11H2,1-2H3;2*6-7,9,12,14H,3-5,8,10-11H2,1-2H3/b10-9+;9-8+;2*7-6+;8-7+;3*7-6+/t19-;18-;3*16-;13-;2*14-/m11111011/s1
• InChIKey: BMSSYTPNFLSZGW-KLFDLVMSSA-N
• XLogP: 15.10
• TPSA: 649.70 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 54
• Rotatable Bonds: 47
• Heavy Atoms: 214
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2946.71
LogP ≤ 5	15.10
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	54

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-ethyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;tert-butyl N-methyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;(E)-1-[(3R)-3-[[4-[(dimethylamino)methyl]triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[[4-(ethylaminomethyl)triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3S)-3-[(2-ethyl-1,3-oxazol-5-yl)methyl]piperidin-1-yl]-3-(1-methyltriazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,2-oxazol-3-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,3-oxazol-2-yl)prop-2-en-1-one;(E)-3-(1-methylpyrazol-4-yl)-1-[(3R)-3-[(4-propyltriazol-1-yl)methyl]piperidin-1-yl]prop-2-en-1-one?

The IUPAC name of tert-butyl N-ethyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;tert-butyl N-methyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;(E)-1-[(3R)-3-[[4-[(dimethylamino)methyl]triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[[4-(ethylaminomethyl)triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3S)-3-[(2-ethyl-1,3-oxazol-5-yl)methyl]piperidin-1-yl]-3-(1-methyltriazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,2-oxazol-3-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,3-oxazol-2-yl)prop-2-en-1-one;(E)-3-(1-methylpyrazol-4-yl)-1-[(3R)-3-[(4-propyltriazol-1-yl)methyl]piperidin-1-yl]prop-2-en-1-one (CID 157397405) is tert-butyl N-ethyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;tert-butyl N-methyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;(E)-1-[(3R)-3-[[4-[(dimethylamino)methyl]triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[[4-(ethylaminomethyl)triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3S)-3-[(2-ethyl-1,3-oxazol-5-yl)methyl]piperidin-1-yl]-3-(1-methyltriazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,2-oxazol-3-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,3-oxazol-2-yl)prop-2-en-1-one;(E)-3-(1-methylpyrazol-4-yl)-1-[(3R)-3-[(4-propyltriazol-1-yl)methyl]piperidin-1-yl]prop-2-en-1-one.

What is the SMILES notation for tert-butyl N-ethyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;tert-butyl N-methyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;(E)-1-[(3R)-3-[[4-[(dimethylamino)methyl]triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[[4-(ethylaminomethyl)triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3S)-3-[(2-ethyl-1,3-oxazol-5-yl)methyl]piperidin-1-yl]-3-(1-methyltriazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,2-oxazol-3-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,3-oxazol-2-yl)prop-2-en-1-one;(E)-3-(1-methylpyrazol-4-yl)-1-[(3R)-3-[(4-propyltriazol-1-yl)methyl]piperidin-1-yl]prop-2-en-1-one?

The canonical SMILES for tert-butyl N-ethyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;tert-butyl N-methyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;(E)-1-[(3R)-3-[[4-[(dimethylamino)methyl]triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[[4-(ethylaminomethyl)triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3S)-3-[(2-ethyl-1,3-oxazol-5-yl)methyl]piperidin-1-yl]-3-(1-methyltriazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,2-oxazol-3-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,3-oxazol-2-yl)prop-2-en-1-one;(E)-3-(1-methylpyrazol-4-yl)-1-[(3R)-3-[(4-propyltriazol-1-yl)methyl]piperidin-1-yl]prop-2-en-1-one is CCCc1cn(C[C@@H]2CCCN(C(=O)/C=C/c3cnn(C)c3)C2)nn1.CCN(Cc1cn(C[C@@H]2CCCN(C(=O)/C=C/c3cnn(C)c3)C2)nn1)C(=O)OC(C)(C)C.CCNCc1cn(C[C@@H]2CCCN(C(=O)/C=C/c3cnn(C)c3)C2)nn1.CCc1cn(C[C@@H]2CCCN(C(=O)/C=C/c3cc(C)on3)C2)nn1.CCc1cn(C[C@@H]2CCCN(C(=O)/C=C/c3ncc(C)o3)C2)nn1.CCc1ncc(C[C@@H]2CCCN(C(=O)/C=C/c3cn(C)nn3)C2)o1.CN(C)Cc1cn(C[C@@H]2CCCN(C(=O)/C=C/c3cnn(C)c3)C2)nn1.CN(Cc1cn(C[C@@H]2CCCN(C(=O)/C=C/c3cnn(C)c3)C2)nn1)C(=O)OC(C)(C)C.

What is the InChIKey of tert-butyl N-ethyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;tert-butyl N-methyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;(E)-1-[(3R)-3-[[4-[(dimethylamino)methyl]triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[[4-(ethylaminomethyl)triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3S)-3-[(2-ethyl-1,3-oxazol-5-yl)methyl]piperidin-1-yl]-3-(1-methyltriazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,2-oxazol-3-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,3-oxazol-2-yl)prop-2-en-1-one;(E)-3-(1-methylpyrazol-4-yl)-1-[(3R)-3-[(4-propyltriazol-1-yl)methyl]piperidin-1-yl]prop-2-en-1-one?

The InChIKey is BMSSYTPNFLSZGW-KLFDLVMSSA-N. The full InChI is InChI=1S/C23H35N7O3.C22H33N7O3.2C18H27N7O.C18H26N6O.3C17H23N5O2/c1-6-28(22(32)33-23(2,3)4)16-20-17-30(26-25-20)15-19-8-7-11-29(14-19)21(31)10-9-18-12-24-27(5)13-18;1-22(2,3)32-21(31)26(4)15-19-16-29(25-24-19)14-18-7-6-10-28(13-18)20(30)9-8-17-11-23-27(5)12-17;1-22(2)13-17-14-25(21-20-17)12-16-5-4-8-24(11-16)18(26)7-6-15-9-19-23(3)10-15;1-3-19-10-17-14-25(22-21-17)13-16-5-4-8-24(12-16)18(26)7-6-15-9-20-23(2)11-15;1-3-5-17-14-24(21-20-17)13-16-6-4-9-23(12-16)18(25)8-7-15-10-19-22(2)11-15;1-3-16-18-10-15(24-16)9-13-5-4-8-22(11-13)17(23)7-6-14-12-21(2)20-19-14;1-3-15-12-22(20-19-15)11-14-5-4-8-21(10-14)17(23)7-6-16-18-9-13(2)24-16;1-3-15-12-22(20-18-15)11-14-5-4-8-21(10-14)17(23)7-6-16-9-13(2)24-19-16/h9-10,12-13,17,19H,6-8,11,14-16H2,1-5H3;8-9,11-12,16,18H,6-7,10,13-15H2,1-5H3;6-7,9-10,14,16H,4-5,8,11-13H2,1-3H3;6-7,9,11,14,16,19H,3-5,8,10,12-13H2,1-2H3;7-8,10-11,14,16H,3-6,9,12-13H2,1-2H3;6-7,10,12-13H,3-5,8-9,11H2,1-2H3;2*6-7,9,12,14H,3-5,8,10-11H2,1-2H3/b10-9+;9-8+;2*7-6+;8-7+;3*7-6+/t19-;18-;3*16-;13-;2*14-/m11111011/s1.

What are the key properties of tert-butyl N-ethyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;tert-butyl N-methyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;(E)-1-[(3R)-3-[[4-[(dimethylamino)methyl]triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[[4-(ethylaminomethyl)triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3S)-3-[(2-ethyl-1,3-oxazol-5-yl)methyl]piperidin-1-yl]-3-(1-methyltriazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,2-oxazol-3-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,3-oxazol-2-yl)prop-2-en-1-one;(E)-3-(1-methylpyrazol-4-yl)-1-[(3R)-3-[(4-propyltriazol-1-yl)methyl]piperidin-1-yl]prop-2-en-1-one?

tert-butyl N-ethyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;tert-butyl N-methyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;(E)-1-[(3R)-3-[[4-[(dimethylamino)methyl]triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[[4-(ethylaminomethyl)triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3S)-3-[(2-ethyl-1,3-oxazol-5-yl)methyl]piperidin-1-yl]-3-(1-methyltriazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,2-oxazol-3-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,3-oxazol-2-yl)prop-2-en-1-one;(E)-3-(1-methylpyrazol-4-yl)-1-[(3R)-3-[(4-propyltriazol-1-yl)methyl]piperidin-1-yl]prop-2-en-1-one has a molecular weight of 2946.71 g/mol, XLogP of 15.10, 47 rotatable bonds, 1 hydrogen bond donors, and 54 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butyl N-ethyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;tert-butyl N-methyl-N-[[1-[[(3R)-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]piperidin-3-yl]methyl]triazol-4-yl]methyl]carbamate;(E)-1-[(3R)-3-[[4-[(dimethylamino)methyl]triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[[4-(ethylaminomethyl)triazol-1-yl]methyl]piperidin-1-yl]-3-(1-methylpyrazol-4-yl)prop-2-en-1-one;(E)-1-[(3S)-3-[(2-ethyl-1,3-oxazol-5-yl)methyl]piperidin-1-yl]-3-(1-methyltriazol-4-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,2-oxazol-3-yl)prop-2-en-1-one;(E)-1-[(3R)-3-[(4-ethyltriazol-1-yl)methyl]piperidin-1-yl]-3-(5-methyl-1,3-oxazol-2-yl)prop-2-en-1-one;(E)-3-(1-methylpyrazol-4-yl)-1-[(3R)-3-[(4-propyltriazol-1-yl)methyl]piperidin-1-yl]prop-2-en-1-one is sourced from PubChem (CID 157397405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).