2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-[4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl]-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-(4-hydroxypiperidine-1-carbonyl)-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[(4-methylpiperidin-4-yl)methyl]pyrimidin-5-yl]ethanone;tert-butyl-dimethyl-piperidin-4-yloxysilane;4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl chloride;piperidin-4-ol;hydrochloride

C115H171Cl2N17O11S3Si3 — CID 158434324

About 2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-[4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl]-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-(4-hydroxypiperidine-1-carbonyl)-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[(4-methylpiperidin-4-yl)methyl]pyrimidin-5-yl]ethanone;tert-butyl-dimethyl-piperidin-4-yloxysilane;4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl chloride;piperidin-4-ol;hydrochloride

2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-[4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl]-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-(4-hydroxypiperidine-1-carbonyl)-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[(4-methylpiperidin-4-yl)methyl]pyrimidin-5-yl]ethanone;tert-butyl-dimethyl-piperidin-4-yloxysilane;4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl chloride;piperidin-4-ol;hydrochloride (PubChem CID 158434324) has the molecular formula C115H171Cl2N17O11S3Si3 and a molecular weight of 2219.11 g/mol. Its IUPAC name is 2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-[4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl]-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-(4-hydroxypiperidine-1-carbonyl)-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[(4-methylpiperidin-4-yl)methyl]pyrimidin-5-yl]ethanone;tert-butyl-dimethyl-piperidin-4-yloxysilane;4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl chloride;piperidin-4-ol;hydrochloride.

Molecular Properties

• Compound Name: 2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-[4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl]-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-(4-hydroxypiperidine-1-carbonyl)-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[(4-methylpiperidin-4-yl)methyl]pyrimidin-5-yl]ethanone;tert-butyl-dimethyl-piperidin-4-yloxysilane;4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl chloride;piperidin-4-ol;hydrochloride
• PubChem CID: 158434324
• Molecular Formula: C115H171Cl2N17O11S3Si3
• Molecular Weight: 2219.11 g/mol
• Exact Mass: 2216.12
• IUPAC Name: 2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-[4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl]-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-(4-hydroxypiperidine-1-carbonyl)-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[(4-methylpiperidin-4-yl)methyl]pyrimidin-5-yl]ethanone;tert-butyl-dimethyl-piperidin-4-yloxysilane;4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl chloride;piperidin-4-ol;hydrochloride
• SMILES: CC(C)(C)[Si](C)(C)OC1CCN(C(=O)Cl)CC1.CC(C)(C)[Si](C)(C)OC1CCNCC1.CC1(Cc2ncc(C(=O)Cc3cc(-c4cccs4)ccc3N)cn2)CCN(C(=O)N2CCC(O)CC2)CC1.CC1(Cc2ncc(C(=O)Cc3cc(-c4cccs4)ccc3N)cn2)CCN(C(=O)N2CCC(O[Si](C)(C)C(C)(C)C)CC2)CC1.CC1(Cc2ncc(C(=O)Cc3cc(-c4cccs4)ccc3N)cn2)CCNCC1.Cl.OC1CCNCC1
• InChI: InChI=1S/C35H49N5O3SSi.C29H35N5O3S.C23H26N4OS.C12H24ClNO2Si.C11H25NOSi.C5H11NO.ClH/c1-34(2,3)45(5,6)43-28-11-15-39(16-12-28)33(42)40-17-13-35(4,14-18-40)22-32-37-23-27(24-38-32)30(41)21-26-20-25(9-10-29(26)36)31-8-7-19-44-31;1-29(8-12-34(13-9-29)28(37)33-10-6-23(35)7-11-33)17-27-31-18-22(19-32-27)25(36)16-21-15-20(4-5-24(21)30)26-3-2-14-38-26;1-23(6-8-25-9-7-23)13-22-26-14-18(15-27-22)20(28)12-17-11-16(4-5-19(17)24)21-3-2-10-29-21;1-12(2,3)17(4,5)16-10-6-8-14(9-7-10)11(13)15;1-11(2,3)14(4,5)13-10-6-8-12-9-7-10;7-5-1-3-6-4-2-5;/h7-10,19-20,23-24,28H,11-18,21-22,36H2,1-6H3;2-5,14-15,18-19,23,35H,6-13,16-17,30H2,1H3;2-5,10-11,14-15,25H,6-9,12-13,24H2,1H3;10H,6-9H2,1-5H3;10,12H,6-9H2,1-5H3;5-7H,1-4H2;1H
• InChIKey: RVUXGCJNEJNIFQ-UHFFFAOYSA-N
• XLogP: 22.79
• TPSA: 378.26 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 26
• Rotatable Bonds: 24
• Heavy Atoms: 151
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2219.11
LogP ≤ 5	22.79
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acid_halide', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'N-C-halo', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-[4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl]-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-(4-hydroxypiperidine-1-carbonyl)-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[(4-methylpiperidin-4-yl)methyl]pyrimidin-5-yl]ethanone;tert-butyl-dimethyl-piperidin-4-yloxysilane;4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl chloride;piperidin-4-ol;hydrochloride?

The IUPAC name of 2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-[4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl]-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-(4-hydroxypiperidine-1-carbonyl)-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[(4-methylpiperidin-4-yl)methyl]pyrimidin-5-yl]ethanone;tert-butyl-dimethyl-piperidin-4-yloxysilane;4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl chloride;piperidin-4-ol;hydrochloride (CID 158434324) is 2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-[4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl]-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-(4-hydroxypiperidine-1-carbonyl)-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[(4-methylpiperidin-4-yl)methyl]pyrimidin-5-yl]ethanone;tert-butyl-dimethyl-piperidin-4-yloxysilane;4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl chloride;piperidin-4-ol;hydrochloride.

What is the SMILES notation for 2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-[4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl]-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-(4-hydroxypiperidine-1-carbonyl)-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[(4-methylpiperidin-4-yl)methyl]pyrimidin-5-yl]ethanone;tert-butyl-dimethyl-piperidin-4-yloxysilane;4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl chloride;piperidin-4-ol;hydrochloride?

The canonical SMILES for 2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-[4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl]-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-(4-hydroxypiperidine-1-carbonyl)-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[(4-methylpiperidin-4-yl)methyl]pyrimidin-5-yl]ethanone;tert-butyl-dimethyl-piperidin-4-yloxysilane;4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl chloride;piperidin-4-ol;hydrochloride is CC(C)(C)[Si](C)(C)OC1CCN(C(=O)Cl)CC1.CC(C)(C)[Si](C)(C)OC1CCNCC1.CC1(Cc2ncc(C(=O)Cc3cc(-c4cccs4)ccc3N)cn2)CCN(C(=O)N2CCC(O)CC2)CC1.CC1(Cc2ncc(C(=O)Cc3cc(-c4cccs4)ccc3N)cn2)CCN(C(=O)N2CCC(O[Si](C)(C)C(C)(C)C)CC2)CC1.CC1(Cc2ncc(C(=O)Cc3cc(-c4cccs4)ccc3N)cn2)CCNCC1.Cl.OC1CCNCC1.

What is the InChIKey of 2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-[4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl]-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-(4-hydroxypiperidine-1-carbonyl)-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[(4-methylpiperidin-4-yl)methyl]pyrimidin-5-yl]ethanone;tert-butyl-dimethyl-piperidin-4-yloxysilane;4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl chloride;piperidin-4-ol;hydrochloride?

The InChIKey is RVUXGCJNEJNIFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H49N5O3SSi.C29H35N5O3S.C23H26N4OS.C12H24ClNO2Si.C11H25NOSi.C5H11NO.ClH/c1-34(2,3)45(5,6)43-28-11-15-39(16-12-28)33(42)40-17-13-35(4,14-18-40)22-32-37-23-27(24-38-32)30(41)21-26-20-25(9-10-29(26)36)31-8-7-19-44-31;1-29(8-12-34(13-9-29)28(37)33-10-6-23(35)7-11-33)17-27-31-18-22(19-32-27)25(36)16-21-15-20(4-5-24(21)30)26-3-2-14-38-26;1-23(6-8-25-9-7-23)13-22-26-14-18(15-27-22)20(28)12-17-11-16(4-5-19(17)24)21-3-2-10-29-21;1-12(2,3)17(4,5)16-10-6-8-14(9-7-10)11(13)15;1-11(2,3)14(4,5)13-10-6-8-12-9-7-10;7-5-1-3-6-4-2-5;/h7-10,19-20,23-24,28H,11-18,21-22,36H2,1-6H3;2-5,14-15,18-19,23,35H,6-13,16-17,30H2,1H3;2-5,10-11,14-15,25H,6-9,12-13,24H2,1H3;10H,6-9H2,1-5H3;10,12H,6-9H2,1-5H3;5-7H,1-4H2;1H.

What are the key properties of 2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-[4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl]-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-(4-hydroxypiperidine-1-carbonyl)-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[(4-methylpiperidin-4-yl)methyl]pyrimidin-5-yl]ethanone;tert-butyl-dimethyl-piperidin-4-yloxysilane;4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl chloride;piperidin-4-ol;hydrochloride?

2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-[4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl]-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-(4-hydroxypiperidine-1-carbonyl)-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[(4-methylpiperidin-4-yl)methyl]pyrimidin-5-yl]ethanone;tert-butyl-dimethyl-piperidin-4-yloxysilane;4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl chloride;piperidin-4-ol;hydrochloride has a molecular weight of 2219.11 g/mol, XLogP of 22.79, 24 rotatable bonds, 8 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-[4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl]-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[[1-(4-hydroxypiperidine-1-carbonyl)-4-methylpiperidin-4-yl]methyl]pyrimidin-5-yl]ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-[2-[(4-methylpiperidin-4-yl)methyl]pyrimidin-5-yl]ethanone;tert-butyl-dimethyl-piperidin-4-yloxysilane;4-[tert-butyl(dimethyl)silyl]oxypiperidine-1-carbonyl chloride;piperidin-4-ol;hydrochloride is sourced from PubChem (CID 158434324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).