C71H105Cl5IN15OSi — CID 160572870
5-chloro-2-[(2S)-4-cyclopropyl-2-methylpiperazin-1-yl]pyridin-4-amine;(2S)-1-(5-chloro-4-iodo-2-pyridinyl)-4-cyclopropyl-2-methylpiperazine;5-chloro-2-[(2S)-2-methylpiperidin-1-yl]pyridine;(2S)-1-(5-chloro-4-methyl-2-pyridinyl)-4-cyclopropyl-2-methylpiperazine;(2S)-1-(5-chloro-2-pyridinyl)-4-cyclopropyl-2-methylpiperazine;trimethyl-(1-methylcyclopropyl)oxysilane (PubChem CID 160572870) has the molecular formula C71H105Cl5IN15OSi and a molecular weight of 1516.98 g/mol. Its IUPAC name is 5-chloro-2-[(2S)-4-cyclopropyl-2-methylpiperazin-1-yl]pyridin-4-amine;(2S)-1-(5-chloro-4-iodo-2-pyridinyl)-4-cyclopropyl-2-methylpiperazine;5-chloro-2-[(2S)-2-methylpiperidin-1-yl]pyridine;(2S)-1-(5-chloro-4-methyl-2-pyridinyl)-4-cyclopropyl-2-methylpiperazine;(2S)-1-(5-chloro-2-pyridinyl)-4-cyclopropyl-2-methylpiperazine;trimethyl-(1-methylcyclopropyl)oxysilane.
| Compound Name | 5-chloro-2-[(2S)-4-cyclopropyl-2-methylpiperazin-1-yl]pyridin-4-amine;(2S)-1-(5-chloro-4-iodo-2-pyridinyl)-4-cyclopropyl-2-methylpiperazine;5-chloro-2-[(2S)-2-methylpiperidin-1-yl]pyridine;(2S)-1-(5-chloro-4-methyl-2-pyridinyl)-4-cyclopropyl-2-methylpiperazine;(2S)-1-(5-chloro-2-pyridinyl)-4-cyclopropyl-2-methylpiperazine;trimethyl-(1-methylcyclopropyl)oxysilane |
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| PubChem CID | 160572870 |
| Molecular Formula | C71H105Cl5IN15OSi |
| Molecular Weight | 1516.98 g/mol |
| Exact Mass | 1513.59 |
| IUPAC Name | 5-chloro-2-[(2S)-4-cyclopropyl-2-methylpiperazin-1-yl]pyridin-4-amine;(2S)-1-(5-chloro-4-iodo-2-pyridinyl)-4-cyclopropyl-2-methylpiperazine;5-chloro-2-[(2S)-2-methylpiperidin-1-yl]pyridine;(2S)-1-(5-chloro-4-methyl-2-pyridinyl)-4-cyclopropyl-2-methylpiperazine;(2S)-1-(5-chloro-2-pyridinyl)-4-cyclopropyl-2-methylpiperazine;trimethyl-(1-methylcyclopropyl)oxysilane |
| SMILES | CC1(O[Si](C)(C)C)CC1.C[C@H]1CCCCN1c1ccc(Cl)cn1.C[C@H]1CN(C2CC2)CCN1c1cc(I)c(Cl)cn1.C[C@H]1CN(C2CC2)CCN1c1cc(N)c(Cl)cn1.C[C@H]1CN(C2CC2)CCN1c1ccc(Cl)cn1.Cc1cc(N2CCN(C3CC3)C[C@@H]2C)ncc1Cl |
| InChI | InChI=1S/C14H20ClN3.C13H17ClIN3.C13H19ClN4.C13H18ClN3.C11H15ClN2.C7H16OSi/c1-10-7-14(16-8-13(10)15)18-6-5-17(9-11(18)2)12-3-4-12;2*1-9-8-17(10-2-3-10)4-5-18(9)13-6-12(15)11(14)7-16-13;1-10-9-16(12-3-4-12)6-7-17(10)13-5-2-11(14)8-15-13;1-9-4-2-3-7-14(9)11-6-5-10(12)8-13-11;1-7(5-6-7)8-9(2,3)4/h7-8,11-12H,3-6,9H2,1-2H3;6-7,9-10H,2-5,8H2,1H3;6-7,9-10H,2-5,8H2,1H3,(H2,15,16);2,5,8,10,12H,3-4,6-7,9H2,1H3;5-6,8-9H,2-4,7H2,1H3;5-6H2,1-4H3/t11-;2*9-;10-;9-;/m00000./s1 |
| InChIKey | RATSNRDRNKHWBW-WAJVZWOXSA-N |
| XLogP | 15.63 |
| TPSA | 128.86 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 16 |
| Rotatable Bonds | 11 |
| Heavy Atoms | 94 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1516.98 |
| LogP ≤ 5 | 15.63 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 16 |
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'} |
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