N,N-bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;4-methyl-2-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1,3-thiazole;N-phenyl-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indazole;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indole;2-[4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]phenyl]tetrazole

C132H210N10O14S7Si2 — CID 159233690

IUPACN,N-bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;4-methyl-2-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1,3-thiazole;N-phenyl-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indazole;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indole;2-[4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]phenyl]tetrazole
SMILESCC(C)S(=O)(=O)CC1CCC(CCc2ccc(-n3ncnn3)cc2)CC1.CC(C)S(=O)(=O)CC1CCC(CCc2ccc(N(CCO[Si](C)(C)C(C)(C)C)CCO[Si](C)(C)C(C)(C)C)cc2)CC1.CC(C)S(=O)(=O)CC1CCC(CCc2ccc(Nc3ccccc3)cc2)CC1.CC(C)S(=O)(=O)CC1CCC(CCc2ccc3[nH]ccc3c2)CC1.CC(C)S(=O)(=O)CC1CCC(CCc2ccc3[nH]ncc3c2)CC1.Cc1csc(CCC2CCC(CS(=O)(=O)C(C)C)CC2)n1
InChIInChI=1S/C34H65NO4SSi2.C24H33NO2S.C20H29NO2S.C19H28N4O2S.C19H28N2O2S.C16H27NO2S2/c1-28(2)40(36,37)27-31-17-15-29(16-18-31)13-14-30-19-21-32(22-20-30)35(23-25-38-41(9,10)33(3,4)5)24-26-39-42(11,12)34(6,7)8;1-19(2)28(26,27)18-22-12-10-20(11-13-22)8-9-21-14-16-24(17-15-21)25-23-6-4-3-5-7-23;1-15(2)24(22,23)14-18-7-4-16(5-8-18)3-6-17-9-10-20-19(13-17)11-12-21-20;1-15(2)26(24,25)13-18-7-5-16(6-8-18)3-4-17-9-11-19(12-10-17)23-21-14-20-22-23;1-14(2)24(22,23)13-17-7-4-15(5-8-17)3-6-16-9-10-19-18(11-16)12-20-21-19;1-12(2)21(18,19)11-15-6-4-14(5-7-15)8-9-16-17-13(3)10-20-16/h19-22,28-29,31H,13-18,23-27H2,1-12H3;3-7,14-17,19-20,22,25H,8-13,18H2,1-2H3;9-13,15-16,18,21H,3-8,14H2,1-2H3;9-12,14-16,18H,3-8,13H2,1-2H3;9-12,14-15,17H,3-8,13H2,1-2H3,(H,20,21);10,12,14-15H,4-9,11H2,1-3H3
InChIKeyKTFDKOZJDKOCRF-UHFFFAOYSA-N
MW2441.83 g/mol
LogP31.18
Rot. Bonds48

About N,N-bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;4-methyl-2-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1,3-thiazole;N-phenyl-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indazole;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indole;2-[4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]phenyl]tetrazole

N,N-bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;4-methyl-2-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1,3-thiazole;N-phenyl-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indazole;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indole;2-[4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]phenyl]tetrazole (PubChem CID 159233690) has the molecular formula C132H210N10O14S7Si2 and a molecular weight of 2441.83 g/mol. Its IUPAC name is N,N-bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;4-methyl-2-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1,3-thiazole;N-phenyl-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indazole;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indole;2-[4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]phenyl]tetrazole.

Molecular Properties

Compound NameN,N-bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;4-methyl-2-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1,3-thiazole;N-phenyl-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indazole;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indole;2-[4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]phenyl]tetrazole
PubChem CID159233690
Molecular FormulaC132H210N10O14S7Si2
Molecular Weight2441.83 g/mol
Exact Mass2439.36
IUPAC NameN,N-bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;4-methyl-2-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1,3-thiazole;N-phenyl-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indazole;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indole;2-[4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]phenyl]tetrazole
SMILESCC(C)S(=O)(=O)CC1CCC(CCc2ccc(-n3ncnn3)cc2)CC1.CC(C)S(=O)(=O)CC1CCC(CCc2ccc(N(CCO[Si](C)(C)C(C)(C)C)CCO[Si](C)(C)C(C)(C)C)cc2)CC1.CC(C)S(=O)(=O)CC1CCC(CCc2ccc(Nc3ccccc3)cc2)CC1.CC(C)S(=O)(=O)CC1CCC(CCc2ccc3[nH]ccc3c2)CC1.CC(C)S(=O)(=O)CC1CCC(CCc2ccc3[nH]ncc3c2)CC1.Cc1csc(CCC2CCC(CS(=O)(=O)C(C)C)CC2)n1
InChIInChI=1S/C34H65NO4SSi2.C24H33NO2S.C20H29NO2S.C19H28N4O2S.C19H28N2O2S.C16H27NO2S2/c1-28(2)40(36,37)27-31-17-15-29(16-18-31)13-14-30-19-21-32(22-20-30)35(23-25-38-41(9,10)33(3,4)5)24-26-39-42(11,12)34(6,7)8;1-19(2)28(26,27)18-22-12-10-20(11-13-22)8-9-21-14-16-24(17-15-21)25-23-6-4-3-5-7-23;1-15(2)24(22,23)14-18-7-4-16(5-8-18)3-6-17-9-10-20-19(13-17)11-12-21-20;1-15(2)26(24,25)13-18-7-5-16(6-8-18)3-4-17-9-11-19(12-10-17)23-21-14-20-22-23;1-14(2)24(22,23)13-17-7-4-15(5-8-17)3-6-16-9-10-19-18(11-16)12-20-21-19;1-12(2)21(18,19)11-15-6-4-14(5-7-15)8-9-16-17-13(3)10-20-16/h19-22,28-29,31H,13-18,23-27H2,1-12H3;3-7,14-17,19-20,22,25H,8-13,18H2,1-2H3;9-13,15-16,18,21H,3-8,14H2,1-2H3;9-12,14-16,18H,3-8,13H2,1-2H3;9-12,14-15,17H,3-8,13H2,1-2H3,(H,20,21);10,12,14-15H,4-9,11H2,1-3H3
InChIKeyKTFDKOZJDKOCRF-UHFFFAOYSA-N
XLogP31.18
TPSA339.53 Ų
H-Bond Donors3
H-Bond Acceptors23
Rotatable Bonds48
Heavy Atoms165
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002441.83
LogP ≤ 531.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze N,N-bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;4-methyl-2-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1,3-thiazole;N-phenyl-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indazole;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indole;2-[4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]phenyl]tetrazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of N,N-bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;4-methyl-2-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1,3-thiazole;N-phenyl-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indazole;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indole;2-[4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]phenyl]tetrazole?
The IUPAC name of N,N-bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;4-methyl-2-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1,3-thiazole;N-phenyl-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indazole;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indole;2-[4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]phenyl]tetrazole (CID 159233690) is N,N-bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;4-methyl-2-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1,3-thiazole;N-phenyl-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indazole;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indole;2-[4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]phenyl]tetrazole.
What is the SMILES notation for N,N-bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;4-methyl-2-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1,3-thiazole;N-phenyl-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indazole;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indole;2-[4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]phenyl]tetrazole?
The canonical SMILES for N,N-bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;4-methyl-2-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1,3-thiazole;N-phenyl-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indazole;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indole;2-[4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]phenyl]tetrazole is CC(C)S(=O)(=O)CC1CCC(CCc2ccc(-n3ncnn3)cc2)CC1.CC(C)S(=O)(=O)CC1CCC(CCc2ccc(N(CCO[Si](C)(C)C(C)(C)C)CCO[Si](C)(C)C(C)(C)C)cc2)CC1.CC(C)S(=O)(=O)CC1CCC(CCc2ccc(Nc3ccccc3)cc2)CC1.CC(C)S(=O)(=O)CC1CCC(CCc2ccc3[nH]ccc3c2)CC1.CC(C)S(=O)(=O)CC1CCC(CCc2ccc3[nH]ncc3c2)CC1.Cc1csc(CCC2CCC(CS(=O)(=O)C(C)C)CC2)n1.
What is the InChIKey of N,N-bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;4-methyl-2-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1,3-thiazole;N-phenyl-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indazole;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indole;2-[4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]phenyl]tetrazole?
The InChIKey is KTFDKOZJDKOCRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H65NO4SSi2.C24H33NO2S.C20H29NO2S.C19H28N4O2S.C19H28N2O2S.C16H27NO2S2/c1-28(2)40(36,37)27-31-17-15-29(16-18-31)13-14-30-19-21-32(22-20-30)35(23-25-38-41(9,10)33(3,4)5)24-26-39-42(11,12)34(6,7)8;1-19(2)28(26,27)18-22-12-10-20(11-13-22)8-9-21-14-16-24(17-15-21)25-23-6-4-3-5-7-23;1-15(2)24(22,23)14-18-7-4-16(5-8-18)3-6-17-9-10-20-19(13-17)11-12-21-20;1-15(2)26(24,25)13-18-7-5-16(6-8-18)3-4-17-9-11-19(12-10-17)23-21-14-20-22-23;1-14(2)24(22,23)13-17-7-4-15(5-8-17)3-6-16-9-10-19-18(11-16)12-20-21-19;1-12(2)21(18,19)11-15-6-4-14(5-7-15)8-9-16-17-13(3)10-20-16/h19-22,28-29,31H,13-18,23-27H2,1-12H3;3-7,14-17,19-20,22,25H,8-13,18H2,1-2H3;9-13,15-16,18,21H,3-8,14H2,1-2H3;9-12,14-16,18H,3-8,13H2,1-2H3;9-12,14-15,17H,3-8,13H2,1-2H3,(H,20,21);10,12,14-15H,4-9,11H2,1-3H3.
What are the key properties of N,N-bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;4-methyl-2-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1,3-thiazole;N-phenyl-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indazole;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indole;2-[4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]phenyl]tetrazole?
N,N-bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;4-methyl-2-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1,3-thiazole;N-phenyl-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indazole;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indole;2-[4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]phenyl]tetrazole has a molecular weight of 2441.83 g/mol, XLogP of 31.18, 48 rotatable bonds, 3 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;4-methyl-2-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1,3-thiazole;N-phenyl-4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]aniline;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indazole;5-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]-1H-indole;2-[4-[2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]phenyl]tetrazole is sourced from PubChem (CID 159233690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).