2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethanamine;2-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;N-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxamide;7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-2-[2-hydroxy-1-[3-(trifluoromethyl)phenyl]ethyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxylic acid;deuterium monohydride;1,2-dibromoethane;methane

C119H170Br2Cl4F12N16O9Si3 — CID 161170261

IUPAC2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethanamine;2-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;N-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxamide;7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-2-[2-hydroxy-1-[3-(trifluoromethyl)phenyl]ethyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxylic acid;deuterium monohydride;1,2-dibromoethane;methane
SMILESBrCCBr.C.C.C.C.C.C.C.CC(C)(C)[Si](C)(C)OCC(N)c1cccc(C(F)(F)F)c1.CC(C)Nc1cc(-c2c[nH]c(C(=O)NC(CO[Si](C)(C)C(C)(C)C)c3cccc(C(F)(F)F)c3)c2)c(Cl)cn1.CC(C)Nc1cc(-c2c[nH]c(C(=O)O)c2)c(Cl)cn1.CC(C)Nc1cc(-c2cc3n(c2)CCN(C(CO)c2cccc(C(F)(F)F)c2)C3=O)c(Cl)cn1.CC(C)Nc1cc(-c2cc3n(c2)CCN(C(CO[Si](C)(C)C(C)(C)C)c2cccc(C(F)(F)F)c2)C3=O)c(Cl)cn1.[H][2H]
InChIInChI=1S/C30H38ClF3N4O2Si.C28H36ClF3N4O2Si.C24H24ClF3N4O2.C15H24F3NOSi.C13H14ClN3O2.C2H4Br2.7CH4.H2/c1-19(2)36-27-15-23(24(31)16-35-27)21-14-25-28(39)38(12-11-37(25)17-21)26(18-40-41(6,7)29(3,4)5)20-9-8-10-22(13-20)30(32,33)34;1-17(2)35-25-13-21(22(29)15-34-25)19-12-23(33-14-19)26(37)36-24(16-38-39(6,7)27(3,4)5)18-9-8-10-20(11-18)28(30,31)32;1-14(2)30-22-10-18(19(25)11-29-22)16-9-20-23(34)32(7-6-31(20)12-16)21(13-33)15-4-3-5-17(8-15)24(26,27)28;1-14(2,3)21(4,5)20-10-13(19)11-7-6-8-12(9-11)15(16,17)18;1-7(2)17-12-4-9(10(14)6-16-12)8-3-11(13(18)19)15-5-8;3-1-2-4;;;;;;;;/h8-10,13-17,19,26H,11-12,18H2,1-7H3,(H,35,36);8-15,17,24,33H,16H2,1-7H3,(H,34,35)(H,36,37);3-5,8-12,14,21,33H,6-7,13H2,1-2H3,(H,29,30);6-9,13H,10,19H2,1-5H3;3-7,15H,1-2H3,(H,16,17)(H,18,19);1-2H2;7*1H4;1H/i;;;;;;;;;;;;;1+1
InChIKeyURBWHTAZXUAINA-RKKUYXDDSA-N
MW2583.63 g/mol
LogP36.01
Rot. Bonds32

About 2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethanamine;2-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;N-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxamide;7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-2-[2-hydroxy-1-[3-(trifluoromethyl)phenyl]ethyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxylic acid;deuterium monohydride;1,2-dibromoethane;methane

2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethanamine;2-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;N-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxamide;7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-2-[2-hydroxy-1-[3-(trifluoromethyl)phenyl]ethyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxylic acid;deuterium monohydride;1,2-dibromoethane;methane (PubChem CID 161170261) has the molecular formula C119H170Br2Cl4F12N16O9Si3 and a molecular weight of 2583.63 g/mol. Its IUPAC name is 2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethanamine;2-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;N-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxamide;7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-2-[2-hydroxy-1-[3-(trifluoromethyl)phenyl]ethyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxylic acid;deuterium monohydride;1,2-dibromoethane;methane.

Molecular Properties

Compound Name2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethanamine;2-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;N-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxamide;7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-2-[2-hydroxy-1-[3-(trifluoromethyl)phenyl]ethyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxylic acid;deuterium monohydride;1,2-dibromoethane;methane
PubChem CID161170261
Molecular FormulaC119H170Br2Cl4F12N16O9Si3
Molecular Weight2583.63 g/mol
Exact Mass2577.96
IUPAC Name2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethanamine;2-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;N-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxamide;7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-2-[2-hydroxy-1-[3-(trifluoromethyl)phenyl]ethyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxylic acid;deuterium monohydride;1,2-dibromoethane;methane
SMILESBrCCBr.C.C.C.C.C.C.C.CC(C)(C)[Si](C)(C)OCC(N)c1cccc(C(F)(F)F)c1.CC(C)Nc1cc(-c2c[nH]c(C(=O)NC(CO[Si](C)(C)C(C)(C)C)c3cccc(C(F)(F)F)c3)c2)c(Cl)cn1.CC(C)Nc1cc(-c2c[nH]c(C(=O)O)c2)c(Cl)cn1.CC(C)Nc1cc(-c2cc3n(c2)CCN(C(CO)c2cccc(C(F)(F)F)c2)C3=O)c(Cl)cn1.CC(C)Nc1cc(-c2cc3n(c2)CCN(C(CO[Si](C)(C)C(C)(C)C)c2cccc(C(F)(F)F)c2)C3=O)c(Cl)cn1.[H][2H]
InChIInChI=1S/C30H38ClF3N4O2Si.C28H36ClF3N4O2Si.C24H24ClF3N4O2.C15H24F3NOSi.C13H14ClN3O2.C2H4Br2.7CH4.H2/c1-19(2)36-27-15-23(24(31)16-35-27)21-14-25-28(39)38(12-11-37(25)17-21)26(18-40-41(6,7)29(3,4)5)20-9-8-10-22(13-20)30(32,33)34;1-17(2)35-25-13-21(22(29)15-34-25)19-12-23(33-14-19)26(37)36-24(16-38-39(6,7)27(3,4)5)18-9-8-10-20(11-18)28(30,31)32;1-14(2)30-22-10-18(19(25)11-29-22)16-9-20-23(34)32(7-6-31(20)12-16)21(13-33)15-4-3-5-17(8-15)24(26,27)28;1-14(2,3)21(4,5)20-10-13(19)11-7-6-8-12(9-11)15(16,17)18;1-7(2)17-12-4-9(10(14)6-16-12)8-3-11(13(18)19)15-5-8;3-1-2-4;;;;;;;;/h8-10,13-17,19,26H,11-12,18H2,1-7H3,(H,35,36);8-15,17,24,33H,16H2,1-7H3,(H,34,35)(H,36,37);3-5,8-12,14,21,33H,6-7,13H2,1-2H3,(H,29,30);6-9,13H,10,19H2,1-5H3;3-7,15H,1-2H3,(H,16,17)(H,18,19);1-2H2;7*1H4;1H/i;;;;;;;;;;;;;1+1
InChIKeyURBWHTAZXUAINA-RKKUYXDDSA-N
XLogP36.01
TPSA322.08 Ų
H-Bond Donors10
H-Bond Acceptors19
Rotatable Bonds32
Heavy Atoms165
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002583.63
LogP ≤ 536.01
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1019

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze 2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethanamine;2-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;N-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxamide;7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-2-[2-hydroxy-1-[3-(trifluoromethyl)phenyl]ethyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxylic acid;deuterium monohydride;1,2-dibromoethane;methane with MolForge

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Related Compounds

[2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]methanamine;N-[[2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]methyl]-4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxamide;4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-N-[[2-(hydroxymethyl)phenyl]methyl]-1H-pyrrole-2-carboxamide;4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxylic acid;methane
CID 157726064
4-[2-[[(2S)-butan-2-yl]amino]-5-chloro-4-pyridinyl]-N-[(1S)-1-(3-chlorophenyl)-2-hydroxyethyl]-1H-pyrrole-2-carboxamide;bis(4-[5-chloro-2-[[(2S)-1-hydroxybutan-2-yl]amino]-4-pyridinyl]-N-[(1S)-1-(3-chlorophenyl)-2-hydroxyethyl]-1H-pyrrole-2-carboxamide);4-[5-chloro-2-[[(2S)-1-hydroxybutan-2-yl]amino]-4-pyridinyl]-N-[(1S)-2-hydroxy-1-phenylethyl]-1H-pyrrole-2-carboxamide;4-[5-chloro-2-[[(2R)-1-hydroxypropan-2-yl]amino]-4-pyridinyl]-N-[(1S)-2-hydroxy-1-(3-methylphenyl)ethyl]-1H-pyrrole-2-carboxamide;N-[(1R)-1-(3-chlorophenyl)-2-hydroxyethyl]-4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxamide
CID 159423648

Frequently Asked Questions

What is the IUPAC name of 2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethanamine;2-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;N-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxamide;7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-2-[2-hydroxy-1-[3-(trifluoromethyl)phenyl]ethyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxylic acid;deuterium monohydride;1,2-dibromoethane;methane?
The IUPAC name of 2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethanamine;2-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;N-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxamide;7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-2-[2-hydroxy-1-[3-(trifluoromethyl)phenyl]ethyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxylic acid;deuterium monohydride;1,2-dibromoethane;methane (CID 161170261) is 2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethanamine;2-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;N-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxamide;7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-2-[2-hydroxy-1-[3-(trifluoromethyl)phenyl]ethyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxylic acid;deuterium monohydride;1,2-dibromoethane;methane.
What is the SMILES notation for 2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethanamine;2-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;N-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxamide;7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-2-[2-hydroxy-1-[3-(trifluoromethyl)phenyl]ethyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxylic acid;deuterium monohydride;1,2-dibromoethane;methane?
The canonical SMILES for 2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethanamine;2-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;N-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxamide;7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-2-[2-hydroxy-1-[3-(trifluoromethyl)phenyl]ethyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxylic acid;deuterium monohydride;1,2-dibromoethane;methane is BrCCBr.C.C.C.C.C.C.C.CC(C)(C)[Si](C)(C)OCC(N)c1cccc(C(F)(F)F)c1.CC(C)Nc1cc(-c2c[nH]c(C(=O)NC(CO[Si](C)(C)C(C)(C)C)c3cccc(C(F)(F)F)c3)c2)c(Cl)cn1.CC(C)Nc1cc(-c2c[nH]c(C(=O)O)c2)c(Cl)cn1.CC(C)Nc1cc(-c2cc3n(c2)CCN(C(CO)c2cccc(C(F)(F)F)c2)C3=O)c(Cl)cn1.CC(C)Nc1cc(-c2cc3n(c2)CCN(C(CO[Si](C)(C)C(C)(C)C)c2cccc(C(F)(F)F)c2)C3=O)c(Cl)cn1.[H][2H].
What is the InChIKey of 2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethanamine;2-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;N-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxamide;7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-2-[2-hydroxy-1-[3-(trifluoromethyl)phenyl]ethyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxylic acid;deuterium monohydride;1,2-dibromoethane;methane?
The InChIKey is URBWHTAZXUAINA-RKKUYXDDSA-N. The full InChI is InChI=1S/C30H38ClF3N4O2Si.C28H36ClF3N4O2Si.C24H24ClF3N4O2.C15H24F3NOSi.C13H14ClN3O2.C2H4Br2.7CH4.H2/c1-19(2)36-27-15-23(24(31)16-35-27)21-14-25-28(39)38(12-11-37(25)17-21)26(18-40-41(6,7)29(3,4)5)20-9-8-10-22(13-20)30(32,33)34;1-17(2)35-25-13-21(22(29)15-34-25)19-12-23(33-14-19)26(37)36-24(16-38-39(6,7)27(3,4)5)18-9-8-10-20(11-18)28(30,31)32;1-14(2)30-22-10-18(19(25)11-29-22)16-9-20-23(34)32(7-6-31(20)12-16)21(13-33)15-4-3-5-17(8-15)24(26,27)28;1-14(2,3)21(4,5)20-10-13(19)11-7-6-8-12(9-11)15(16,17)18;1-7(2)17-12-4-9(10(14)6-16-12)8-3-11(13(18)19)15-5-8;3-1-2-4;;;;;;;;/h8-10,13-17,19,26H,11-12,18H2,1-7H3,(H,35,36);8-15,17,24,33H,16H2,1-7H3,(H,34,35)(H,36,37);3-5,8-12,14,21,33H,6-7,13H2,1-2H3,(H,29,30);6-9,13H,10,19H2,1-5H3;3-7,15H,1-2H3,(H,16,17)(H,18,19);1-2H2;7*1H4;1H/i;;;;;;;;;;;;;1+1.
What are the key properties of 2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethanamine;2-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;N-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxamide;7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-2-[2-hydroxy-1-[3-(trifluoromethyl)phenyl]ethyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxylic acid;deuterium monohydride;1,2-dibromoethane;methane?
2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethanamine;2-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;N-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxamide;7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-2-[2-hydroxy-1-[3-(trifluoromethyl)phenyl]ethyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxylic acid;deuterium monohydride;1,2-dibromoethane;methane has a molecular weight of 2583.63 g/mol, XLogP of 36.01, 32 rotatable bonds, 10 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethanamine;2-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;N-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3-(trifluoromethyl)phenyl]ethyl]-4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxamide;7-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-2-[2-hydroxy-1-[3-(trifluoromethyl)phenyl]ethyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one;4-[5-chloro-2-(propan-2-ylamino)-4-pyridinyl]-1H-pyrrole-2-carboxylic acid;deuterium monohydride;1,2-dibromoethane;methane is sourced from PubChem (CID 161170261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).