bis(4-[[8-(4-acetamido-4-methylpiperidin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide);acetyl chloride;4-[(4-bromopyrazolo[1,5-a]pyridin-2-yl)amino]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide;bis(tert-butyl 4-acetamido-4-methylpiperidine-1-carboxylate);bis(tert-butyl 4-amino-4-methylpiperidine-1-carboxylate);N-(4-methylpiperidin-4-yl)acetamide

C139H216BrCl2N29O18 — CID 159471658

About bis(4-[[8-(4-acetamido-4-methylpiperidin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide);acetyl chloride;4-[(4-bromopyrazolo[1,5-a]pyridin-2-yl)amino]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide;bis(tert-butyl 4-acetamido-4-methylpiperidine-1-carboxylate);bis(tert-butyl 4-amino-4-methylpiperidine-1-carboxylate);N-(4-methylpiperidin-4-yl)acetamide

bis(4-[[8-(4-acetamido-4-methylpiperidin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide);acetyl chloride;4-[(4-bromopyrazolo[1,5-a]pyridin-2-yl)amino]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide;bis(tert-butyl 4-acetamido-4-methylpiperidine-1-carboxylate);bis(tert-butyl 4-amino-4-methylpiperidine-1-carboxylate);N-(4-methylpiperidin-4-yl)acetamide (PubChem CID 159471658) has the molecular formula C139H216BrCl2N29O18 and a molecular weight of 2732.25 g/mol. Its IUPAC name is bis(4-[[8-(4-acetamido-4-methylpiperidin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide);acetyl chloride;4-[(4-bromopyrazolo[1,5-a]pyridin-2-yl)amino]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide;bis(tert-butyl 4-acetamido-4-methylpiperidine-1-carboxylate);bis(tert-butyl 4-amino-4-methylpiperidine-1-carboxylate);N-(4-methylpiperidin-4-yl)acetamide.

Molecular Properties

• Compound Name: bis(4-[[8-(4-acetamido-4-methylpiperidin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide);acetyl chloride;4-[(4-bromopyrazolo[1,5-a]pyridin-2-yl)amino]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide;bis(tert-butyl 4-acetamido-4-methylpiperidine-1-carboxylate);bis(tert-butyl 4-amino-4-methylpiperidine-1-carboxylate);N-(4-methylpiperidin-4-yl)acetamide
• PubChem CID: 159471658
• Molecular Formula: C139H216BrCl2N29O18
• Molecular Weight: 2732.25 g/mol
• Exact Mass: 2728.54
• IUPAC Name: bis(4-[[8-(4-acetamido-4-methylpiperidin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide);acetyl chloride;4-[(4-bromopyrazolo[1,5-a]pyridin-2-yl)amino]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide;bis(tert-butyl 4-acetamido-4-methylpiperidine-1-carboxylate);bis(tert-butyl 4-amino-4-methylpiperidine-1-carboxylate);N-(4-methylpiperidin-4-yl)acetamide
• SMILES: CC(=O)Cl.CC(=O)Cl.CC(=O)NC1(C)CCN(C(=O)OC(C)(C)C)CC1.CC(=O)NC1(C)CCN(C(=O)OC(C)(C)C)CC1.CC(=O)NC1(C)CCN(c2cccn3nc(Cc4ccc(C(=O)N(C)C5CCN(C)CC5)cc4)nc23)CC1.CC(=O)NC1(C)CCN(c2cccn3nc(Cc4ccc(C(=O)N(C)C5CCN(C)CC5)cc4)nc23)CC1.CC(=O)NC1(C)CCNCC1.CC1(N)CCN(C(=O)OC(C)(C)C)CC1.CC1(N)CCN(C(=O)OC(C)(C)C)CC1.CN1CCC(N(C)C(=O)c2ccc(Nc3cc4c(Br)cccn4n3)cc2)CC1
• InChI: InChI=1S/2C29H39N7O2.C21H24BrN5O.2C13H24N2O3.2C11H22N2O2.C8H16N2O.2C2H3ClO/c2*1-21(37)31-29(2)13-18-35(19-14-29)25-6-5-15-36-27(25)30-26(32-36)20-22-7-9-23(10-8-22)28(38)34(4)24-11-16-33(3)17-12-24;1-25-12-9-17(10-13-25)26(2)21(28)15-5-7-16(8-6-15)23-20-14-19-18(22)4-3-11-27(19)24-20;2*1-10(16)14-13(5)6-8-15(9-7-13)11(17)18-12(2,3)4;2*1-10(2,3)15-9(14)13-7-5-11(4,12)6-8-13;1-7(11)10-8(2)3-5-9-6-4-8;2*1-2(3)4/h2*5-10,15,24H,11-14,16-20H2,1-4H3,(H,31,37);3-8,11,14,17H,9-10,12-13H2,1-2H3,(H,23,24);2*6-9H2,1-5H3,(H,14,16);2*5-8,12H2,1-4H3;9H,3-6H2,1-2H3,(H,10,11);2*1H3
• InChIKey: LVWPFCJIUYTQKZ-UHFFFAOYSA-N
• XLogP: 19.07
• TPSA: 528.71 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 35
• Rotatable Bonds: 19
• Heavy Atoms: 189
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2732.25
LogP ≤ 5	19.07
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	35

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of bis(4-[[8-(4-acetamido-4-methylpiperidin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide);acetyl chloride;4-[(4-bromopyrazolo[1,5-a]pyridin-2-yl)amino]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide;bis(tert-butyl 4-acetamido-4-methylpiperidine-1-carboxylate);bis(tert-butyl 4-amino-4-methylpiperidine-1-carboxylate);N-(4-methylpiperidin-4-yl)acetamide?

The IUPAC name of bis(4-[[8-(4-acetamido-4-methylpiperidin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide);acetyl chloride;4-[(4-bromopyrazolo[1,5-a]pyridin-2-yl)amino]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide;bis(tert-butyl 4-acetamido-4-methylpiperidine-1-carboxylate);bis(tert-butyl 4-amino-4-methylpiperidine-1-carboxylate);N-(4-methylpiperidin-4-yl)acetamide (CID 159471658) is bis(4-[[8-(4-acetamido-4-methylpiperidin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide);acetyl chloride;4-[(4-bromopyrazolo[1,5-a]pyridin-2-yl)amino]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide;bis(tert-butyl 4-acetamido-4-methylpiperidine-1-carboxylate);bis(tert-butyl 4-amino-4-methylpiperidine-1-carboxylate);N-(4-methylpiperidin-4-yl)acetamide.

What is the SMILES notation for bis(4-[[8-(4-acetamido-4-methylpiperidin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide);acetyl chloride;4-[(4-bromopyrazolo[1,5-a]pyridin-2-yl)amino]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide;bis(tert-butyl 4-acetamido-4-methylpiperidine-1-carboxylate);bis(tert-butyl 4-amino-4-methylpiperidine-1-carboxylate);N-(4-methylpiperidin-4-yl)acetamide?

The canonical SMILES for bis(4-[[8-(4-acetamido-4-methylpiperidin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide);acetyl chloride;4-[(4-bromopyrazolo[1,5-a]pyridin-2-yl)amino]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide;bis(tert-butyl 4-acetamido-4-methylpiperidine-1-carboxylate);bis(tert-butyl 4-amino-4-methylpiperidine-1-carboxylate);N-(4-methylpiperidin-4-yl)acetamide is CC(=O)Cl.CC(=O)Cl.CC(=O)NC1(C)CCN(C(=O)OC(C)(C)C)CC1.CC(=O)NC1(C)CCN(C(=O)OC(C)(C)C)CC1.CC(=O)NC1(C)CCN(c2cccn3nc(Cc4ccc(C(=O)N(C)C5CCN(C)CC5)cc4)nc23)CC1.CC(=O)NC1(C)CCN(c2cccn3nc(Cc4ccc(C(=O)N(C)C5CCN(C)CC5)cc4)nc23)CC1.CC(=O)NC1(C)CCNCC1.CC1(N)CCN(C(=O)OC(C)(C)C)CC1.CC1(N)CCN(C(=O)OC(C)(C)C)CC1.CN1CCC(N(C)C(=O)c2ccc(Nc3cc4c(Br)cccn4n3)cc2)CC1.

What is the InChIKey of bis(4-[[8-(4-acetamido-4-methylpiperidin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide);acetyl chloride;4-[(4-bromopyrazolo[1,5-a]pyridin-2-yl)amino]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide;bis(tert-butyl 4-acetamido-4-methylpiperidine-1-carboxylate);bis(tert-butyl 4-amino-4-methylpiperidine-1-carboxylate);N-(4-methylpiperidin-4-yl)acetamide?

The InChIKey is LVWPFCJIUYTQKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C29H39N7O2.C21H24BrN5O.2C13H24N2O3.2C11H22N2O2.C8H16N2O.2C2H3ClO/c2*1-21(37)31-29(2)13-18-35(19-14-29)25-6-5-15-36-27(25)30-26(32-36)20-22-7-9-23(10-8-22)28(38)34(4)24-11-16-33(3)17-12-24;1-25-12-9-17(10-13-25)26(2)21(28)15-5-7-16(8-6-15)23-20-14-19-18(22)4-3-11-27(19)24-20;2*1-10(16)14-13(5)6-8-15(9-7-13)11(17)18-12(2,3)4;2*1-10(2,3)15-9(14)13-7-5-11(4,12)6-8-13;1-7(11)10-8(2)3-5-9-6-4-8;2*1-2(3)4/h2*5-10,15,24H,11-14,16-20H2,1-4H3,(H,31,37);3-8,11,14,17H,9-10,12-13H2,1-2H3,(H,23,24);2*6-9H2,1-5H3,(H,14,16);2*5-8,12H2,1-4H3;9H,3-6H2,1-2H3,(H,10,11);2*1H3.

What are the key properties of bis(4-[[8-(4-acetamido-4-methylpiperidin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide);acetyl chloride;4-[(4-bromopyrazolo[1,5-a]pyridin-2-yl)amino]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide;bis(tert-butyl 4-acetamido-4-methylpiperidine-1-carboxylate);bis(tert-butyl 4-amino-4-methylpiperidine-1-carboxylate);N-(4-methylpiperidin-4-yl)acetamide?

bis(4-[[8-(4-acetamido-4-methylpiperidin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide);acetyl chloride;4-[(4-bromopyrazolo[1,5-a]pyridin-2-yl)amino]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide;bis(tert-butyl 4-acetamido-4-methylpiperidine-1-carboxylate);bis(tert-butyl 4-amino-4-methylpiperidine-1-carboxylate);N-(4-methylpiperidin-4-yl)acetamide has a molecular weight of 2732.25 g/mol, XLogP of 19.07, 19 rotatable bonds, 9 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for bis(4-[[8-(4-acetamido-4-methylpiperidin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide);acetyl chloride;4-[(4-bromopyrazolo[1,5-a]pyridin-2-yl)amino]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide;bis(tert-butyl 4-acetamido-4-methylpiperidine-1-carboxylate);bis(tert-butyl 4-amino-4-methylpiperidine-1-carboxylate);N-(4-methylpiperidin-4-yl)acetamide is sourced from PubChem (CID 159471658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).