2-(4-tert-butylphenoxy)ethanol;1-[2-(3-tert-butylphenoxy)ethyl]pyrrolidine;1-[2-(4-tert-butylphenoxy)ethyl]pyrrolidine;1-(4-tert-butylphenyl)imidazole;4-[(4-tert-butylphenyl)methyl]morpholine;1-[(3-tert-butylphenyl)methyl]piperazine;1-(4-tert-butylphenyl)-4-methylpiperazine;1-[(4-tert-butylphenyl)methyl]pyrazole;1-(3-tert-butylphenyl)piperazine;4-(4-tert-butylphenyl)sulfonylpiperidine;4-tert-butyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide

C161H244N16O9S2 — CID 158881701

IUPAC2-(4-tert-butylphenoxy)ethanol;1-[2-(3-tert-butylphenoxy)ethyl]pyrrolidine;1-[2-(4-tert-butylphenoxy)ethyl]pyrrolidine;1-(4-tert-butylphenyl)imidazole;4-[(4-tert-butylphenyl)methyl]morpholine;1-[(3-tert-butylphenyl)methyl]piperazine;1-(4-tert-butylphenyl)-4-methylpiperazine;1-[(4-tert-butylphenyl)methyl]pyrazole;1-(3-tert-butylphenyl)piperazine;4-(4-tert-butylphenyl)sulfonylpiperidine;4-tert-butyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide
SMILESCC(C)(C)c1ccc(-n2ccnc2)cc1.CC(C)(C)c1ccc(CN2CCOCC2)cc1.CC(C)(C)c1ccc(Cn2cccn2)cc1.CC(C)(C)c1ccc(OCCN2CCCC2)cc1.CC(C)(C)c1ccc(OCCO)cc1.CC(C)(C)c1ccc(S(=O)(=O)C2CCNCC2)cc1.CC(C)(C)c1ccc(S(=O)(=O)NCCN2CCCC2)cc1.CC(C)(C)c1cccc(CN2CCNCC2)c1.CC(C)(C)c1cccc(N2CCNCC2)c1.CC(C)(C)c1cccc(OCCN2CCCC2)c1.CN1CCN(c2ccc(C(C)(C)C)cc2)CC1
InChIInChI=1S/C16H26N2O2S.2C16H25NO.2C15H24N2.C15H23NO2S.C15H23NO.C14H18N2.C14H22N2.C13H16N2.C12H18O2/c1-16(2,3)14-6-8-15(9-7-14)21(19,20)17-10-13-18-11-4-5-12-18;1-16(2,3)14-6-8-15(9-7-14)18-13-12-17-10-4-5-11-17;1-16(2,3)14-7-6-8-15(13-14)18-12-11-17-9-4-5-10-17;1-15(2,3)13-5-7-14(8-6-13)17-11-9-16(4)10-12-17;1-15(2,3)14-6-4-5-13(11-14)12-17-9-7-16-8-10-17;1-15(2,3)12-4-6-13(7-5-12)19(17,18)14-8-10-16-11-9-14;1-15(2,3)14-6-4-13(5-7-14)12-16-8-10-17-11-9-16;1-14(2,3)13-7-5-12(6-8-13)11-16-10-4-9-15-16;1-14(2,3)12-5-4-6-13(11-12)16-9-7-15-8-10-16;1-13(2,3)11-4-6-12(7-5-11)15-9-8-14-10-15;1-12(2,3)10-4-6-11(7-5-10)14-9-8-13/h6-9,17H,4-5,10-13H2,1-3H3;6-9H,4-5,10-13H2,1-3H3;6-8,13H,4-5,9-12H2,1-3H3;5-8H,9-12H2,1-4H3;4-6,11,16H,7-10,12H2,1-3H3;4-7,14,16H,8-11H2,1-3H3;4-7H,8-12H2,1-3H3;4-10H,11H2,1-3H3;4-6,11,15H,7-10H2,1-3H3;4-10H,1-3H3;4-7,13H,8-9H2,1-3H3
InChIKeyJDCKYXCTLKPCOU-UHFFFAOYSA-N
MW2611.96 g/mol
LogP30.87
Rot. Bonds27

About 2-(4-tert-butylphenoxy)ethanol;1-[2-(3-tert-butylphenoxy)ethyl]pyrrolidine;1-[2-(4-tert-butylphenoxy)ethyl]pyrrolidine;1-(4-tert-butylphenyl)imidazole;4-[(4-tert-butylphenyl)methyl]morpholine;1-[(3-tert-butylphenyl)methyl]piperazine;1-(4-tert-butylphenyl)-4-methylpiperazine;1-[(4-tert-butylphenyl)methyl]pyrazole;1-(3-tert-butylphenyl)piperazine;4-(4-tert-butylphenyl)sulfonylpiperidine;4-tert-butyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide

2-(4-tert-butylphenoxy)ethanol;1-[2-(3-tert-butylphenoxy)ethyl]pyrrolidine;1-[2-(4-tert-butylphenoxy)ethyl]pyrrolidine;1-(4-tert-butylphenyl)imidazole;4-[(4-tert-butylphenyl)methyl]morpholine;1-[(3-tert-butylphenyl)methyl]piperazine;1-(4-tert-butylphenyl)-4-methylpiperazine;1-[(4-tert-butylphenyl)methyl]pyrazole;1-(3-tert-butylphenyl)piperazine;4-(4-tert-butylphenyl)sulfonylpiperidine;4-tert-butyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide (PubChem CID 158881701) has the molecular formula C161H244N16O9S2 and a molecular weight of 2611.96 g/mol. Its IUPAC name is 2-(4-tert-butylphenoxy)ethanol;1-[2-(3-tert-butylphenoxy)ethyl]pyrrolidine;1-[2-(4-tert-butylphenoxy)ethyl]pyrrolidine;1-(4-tert-butylphenyl)imidazole;4-[(4-tert-butylphenyl)methyl]morpholine;1-[(3-tert-butylphenyl)methyl]piperazine;1-(4-tert-butylphenyl)-4-methylpiperazine;1-[(4-tert-butylphenyl)methyl]pyrazole;1-(3-tert-butylphenyl)piperazine;4-(4-tert-butylphenyl)sulfonylpiperidine;4-tert-butyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide.

Molecular Properties

Compound Name2-(4-tert-butylphenoxy)ethanol;1-[2-(3-tert-butylphenoxy)ethyl]pyrrolidine;1-[2-(4-tert-butylphenoxy)ethyl]pyrrolidine;1-(4-tert-butylphenyl)imidazole;4-[(4-tert-butylphenyl)methyl]morpholine;1-[(3-tert-butylphenyl)methyl]piperazine;1-(4-tert-butylphenyl)-4-methylpiperazine;1-[(4-tert-butylphenyl)methyl]pyrazole;1-(3-tert-butylphenyl)piperazine;4-(4-tert-butylphenyl)sulfonylpiperidine;4-tert-butyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide
PubChem CID158881701
Molecular FormulaC161H244N16O9S2
Molecular Weight2611.96 g/mol
Exact Mass2609.86
IUPAC Name2-(4-tert-butylphenoxy)ethanol;1-[2-(3-tert-butylphenoxy)ethyl]pyrrolidine;1-[2-(4-tert-butylphenoxy)ethyl]pyrrolidine;1-(4-tert-butylphenyl)imidazole;4-[(4-tert-butylphenyl)methyl]morpholine;1-[(3-tert-butylphenyl)methyl]piperazine;1-(4-tert-butylphenyl)-4-methylpiperazine;1-[(4-tert-butylphenyl)methyl]pyrazole;1-(3-tert-butylphenyl)piperazine;4-(4-tert-butylphenyl)sulfonylpiperidine;4-tert-butyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide
SMILESCC(C)(C)c1ccc(-n2ccnc2)cc1.CC(C)(C)c1ccc(CN2CCOCC2)cc1.CC(C)(C)c1ccc(Cn2cccn2)cc1.CC(C)(C)c1ccc(OCCN2CCCC2)cc1.CC(C)(C)c1ccc(OCCO)cc1.CC(C)(C)c1ccc(S(=O)(=O)C2CCNCC2)cc1.CC(C)(C)c1ccc(S(=O)(=O)NCCN2CCCC2)cc1.CC(C)(C)c1cccc(CN2CCNCC2)c1.CC(C)(C)c1cccc(N2CCNCC2)c1.CC(C)(C)c1cccc(OCCN2CCCC2)c1.CN1CCN(c2ccc(C(C)(C)C)cc2)CC1
InChIInChI=1S/C16H26N2O2S.2C16H25NO.2C15H24N2.C15H23NO2S.C15H23NO.C14H18N2.C14H22N2.C13H16N2.C12H18O2/c1-16(2,3)14-6-8-15(9-7-14)21(19,20)17-10-13-18-11-4-5-12-18;1-16(2,3)14-6-8-15(9-7-14)18-13-12-17-10-4-5-11-17;1-16(2,3)14-7-6-8-15(13-14)18-12-11-17-9-4-5-10-17;1-15(2,3)13-5-7-14(8-6-13)17-11-9-16(4)10-12-17;1-15(2,3)14-6-4-5-13(11-14)12-17-9-7-16-8-10-17;1-15(2,3)12-4-6-13(7-5-12)19(17,18)14-8-10-16-11-9-14;1-15(2,3)14-6-4-13(5-7-14)12-16-8-10-17-11-9-16;1-14(2,3)13-7-5-12(6-8-13)11-16-10-4-9-15-16;1-14(2,3)12-5-4-6-13(11-12)16-9-7-15-8-10-16;1-13(2,3)11-4-6-12(7-5-11)15-9-8-14-10-15;1-12(2,3)10-4-6-11(7-5-10)14-9-8-13/h6-9,17H,4-5,10-13H2,1-3H3;6-9H,4-5,10-13H2,1-3H3;6-8,13H,4-5,9-12H2,1-3H3;5-8H,9-12H2,1-4H3;4-6,11,16H,7-10,12H2,1-3H3;4-7,14,16H,8-11H2,1-3H3;4-7H,8-12H2,1-3H3;4-10H,11H2,1-3H3;4-6,11,15H,7-10H2,1-3H3;4-10H,1-3H3;4-7,13H,8-9H2,1-3H3
InChIKeyJDCKYXCTLKPCOU-UHFFFAOYSA-N
XLogP30.87
TPSA235.11 Ų
H-Bond Donors5
H-Bond Acceptors24
Rotatable Bonds27
Heavy Atoms188
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002611.96
LogP ≤ 530.87
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1024

Analyze 2-(4-tert-butylphenoxy)ethanol;1-[2-(3-tert-butylphenoxy)ethyl]pyrrolidine;1-[2-(4-tert-butylphenoxy)ethyl]pyrrolidine;1-(4-tert-butylphenyl)imidazole;4-[(4-tert-butylphenyl)methyl]morpholine;1-[(3-tert-butylphenyl)methyl]piperazine;1-(4-tert-butylphenyl)-4-methylpiperazine;1-[(4-tert-butylphenyl)methyl]pyrazole;1-(3-tert-butylphenyl)piperazine;4-(4-tert-butylphenyl)sulfonylpiperidine;4-tert-butyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide with MolForge

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Related Compounds

Methane;1-methyl-4-propan-2-ylbenzene;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;5-(piperidin-1-ylmethyl)-2-propan-2-yl-1,3-thiazole;1-(3-propan-2-ylphenoxy)butan-2-ol;4-[2-(4-propan-2-ylphenyl)ethyl]morpholine;4-[(4-propan-2-ylphenyl)methyl]morpholine;1-[(3-propan-2-ylphenyl)methyl]pyrrolidine;1-[(4-propan-2-ylphenyl)methyl]pyrrolidine;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;bis(2-propan-2-ylpyridine);4-[(6-propan-2-yl-2-pyridinyl)methyl]morpholine;2-propan-2-ylpyrimidine;2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)pyridine;2-propan-2-yl-6-(pyrrolidin-1-ylmethyl)pyridine;2-propan-2-yl-1,3-thiazole;4-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]morpholine
CID 157838409
2-(4-tert-butylphenoxy)ethanol;1-[2-(3-tert-butylphenoxy)ethyl]pyrrolidine;1-[2-(4-tert-butylphenoxy)ethyl]pyrrolidine;4-[(4-tert-butylphenyl)methyl]morpholine;1-[(3-tert-butylphenyl)methyl]piperazine;1-[(4-tert-butylphenyl)methyl]pyrazole;1-(3-tert-butylphenyl)piperazine;4-(4-tert-butylphenyl)sulfonylpiperidine;4-tert-butyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide
CID 159484242
2-Tert-butyl-4-propan-2-ylpyridine;2-cyclopropyl-4-propan-2-ylpyrimidine;2-ethyl-4-propan-2-ylpyrimidine;1-fluoro-2-methyl-4-propan-2-ylbenzene;2-fluoro-1-methyl-4-propan-2-ylbenzene;2-(2-fluoro-5-propan-2-ylanilino)ethanol;2-(2-fluoro-5-propan-2-ylphenoxy)ethanol;3-(2-fluoro-5-propan-2-ylphenyl)-1,3-oxazolidin-2-one;2-(methoxymethyl)-4-propan-2-ylpyridine;1-methyl-4-propan-2-ylbenzene;1-methyl-3-propan-2-ylpyrazole;tris(2-methyl-4-propan-2-ylpyrimidine);1-(4-propan-2-ylphenyl)pyrrolidin-2-one;1-propan-2-yl-4-propan-2-ylsulfonylbenzene
CID 159531813
2-(4-tert-butylphenoxy)ethanol;1-[2-(3-tert-butylphenoxy)ethyl]pyrrolidine;1-[2-(4-tert-butylphenoxy)ethyl]pyrrolidine;1-(3-tert-butylphenoxy)piperazine;4-[(4-tert-butylphenyl)methyl]morpholine;1-(4-tert-butylphenyl)-4-methylpiperazine;1-[(4-tert-butylphenyl)methyl]pyrazole;1-(3-tert-butylphenyl)piperazine;4-(4-tert-butylphenyl)sulfonylpiperidine;4-tert-butyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide
CID 159940170
1-tert-butyl-4-cyclohexylsulfonylbenzene;1-[2-(3-tert-butylphenoxy)ethyl]pyrrolidine;1-[2-(4-tert-butylphenoxy)ethyl]pyrrolidine;1-(4-tert-butylphenyl)imidazole;1-(4-tert-butylphenyl)-4-methylpiperazine;1-[(3-tert-butylphenyl)methyl]piperidine;1-[(4-tert-butylphenyl)methyl]piperidine;1-[(4-tert-butylphenyl)methyl]pyrazole;1-(3-tert-butylphenyl)piperidine;1-tert-butyl-4-propoxybenzene;4-tert-butyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide;methane
CID 160573314
4-(4-Tert-butylphenoxy)piperidine;1-[(4-tert-butylphenyl)methyl]imidazole;1-[(4-tert-butylphenyl)methyl]-4-methylpiperazine;4-[(3-tert-butylphenyl)methyl]morpholine;4-(4-tert-butylphenyl)morpholine;1-(4-tert-butylphenyl)piperazine;2-[4-(4-tert-butylphenyl)piperazin-1-yl]ethanol;1-(4-tert-butylphenyl)piperidine;1-(4-tert-butylphenyl)pyrazole;1-(3-tert-butylphenyl)sulfonylpiperidine;1-(5-tert-butyl-2-pyridinyl)piperazine
CID 160842984
1-Methyl-4-propan-2-ylbenzene;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;3-(3-propan-2-ylphenoxy)propane-1,2-diol;4-[2-(4-propan-2-ylphenyl)ethyl]morpholine;4-[(4-propan-2-ylphenyl)methyl]morpholine;1-[(3-propan-2-ylphenyl)methyl]pyrrolidine;1-[(4-propan-2-ylphenyl)methyl]pyrrolidine;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;2-propan-2-ylpyridine;4-[(6-propan-2-yl-2-pyridinyl)methyl]morpholine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)pyridine;2-propan-2-yl-6-(pyrrolidin-1-ylmethyl)pyridine;2-propan-2-yl-1,3-thiazole;4-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]morpholine;4-[(2-propan-2-yl-1,3-thiazol-5-yl)methyl]morpholine
CID 161331070
1-tert-butyl-4-cyclohexylsulfonylbenzene;1-[2-(3-tert-butylphenoxy)ethyl]pyrrolidine;1-[2-(4-tert-butylphenoxy)ethyl]pyrrolidine;1-(4-tert-butylphenyl)-4-methylpiperazine;1-[(3-tert-butylphenyl)methyl]piperidine;1-[(4-tert-butylphenyl)methyl]piperidine;1-[(4-tert-butylphenyl)methyl]pyrazole;1-(3-tert-butylphenyl)piperidine;1-tert-butyl-4-propoxybenzene;4-tert-butyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide
CID 161537830
5-tert-butyl-1-methyl-3,6-dihydro-2H-pyridine;2-tert-butyl-1-methylpyrrole;1-tert-butylpyrazole;4-(5-tert-butyl-1,3-thiazol-2-yl)morpholine;N,N-dimethyl-4-propan-2-ylaniline;2-methoxy-4-propan-2-ylphenol;2-methoxy-N-[(3-propan-2-ylphenyl)methyl]ethanamine;4-(4-methylpentyl)morpholine;1-methylsulfonyl-4-propan-2-ylbenzene;2-morpholin-4-yl-N-[(3-propan-2-ylphenyl)methyl]ethanamine;4-propan-2-ylphenol;4-[3-(4-propan-2-ylphenoxy)propyl]morpholine;4-[(4-propan-2-ylphenyl)methyl]morpholine;4-(6-propan-2-ylpyrimidin-4-yl)morpholine
CID 161601536

Frequently Asked Questions

What is the IUPAC name of 2-(4-tert-butylphenoxy)ethanol;1-[2-(3-tert-butylphenoxy)ethyl]pyrrolidine;1-[2-(4-tert-butylphenoxy)ethyl]pyrrolidine;1-(4-tert-butylphenyl)imidazole;4-[(4-tert-butylphenyl)methyl]morpholine;1-[(3-tert-butylphenyl)methyl]piperazine;1-(4-tert-butylphenyl)-4-methylpiperazine;1-[(4-tert-butylphenyl)methyl]pyrazole;1-(3-tert-butylphenyl)piperazine;4-(4-tert-butylphenyl)sulfonylpiperidine;4-tert-butyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide?
The IUPAC name of 2-(4-tert-butylphenoxy)ethanol;1-[2-(3-tert-butylphenoxy)ethyl]pyrrolidine;1-[2-(4-tert-butylphenoxy)ethyl]pyrrolidine;1-(4-tert-butylphenyl)imidazole;4-[(4-tert-butylphenyl)methyl]morpholine;1-[(3-tert-butylphenyl)methyl]piperazine;1-(4-tert-butylphenyl)-4-methylpiperazine;1-[(4-tert-butylphenyl)methyl]pyrazole;1-(3-tert-butylphenyl)piperazine;4-(4-tert-butylphenyl)sulfonylpiperidine;4-tert-butyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide (CID 158881701) is 2-(4-tert-butylphenoxy)ethanol;1-[2-(3-tert-butylphenoxy)ethyl]pyrrolidine;1-[2-(4-tert-butylphenoxy)ethyl]pyrrolidine;1-(4-tert-butylphenyl)imidazole;4-[(4-tert-butylphenyl)methyl]morpholine;1-[(3-tert-butylphenyl)methyl]piperazine;1-(4-tert-butylphenyl)-4-methylpiperazine;1-[(4-tert-butylphenyl)methyl]pyrazole;1-(3-tert-butylphenyl)piperazine;4-(4-tert-butylphenyl)sulfonylpiperidine;4-tert-butyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide.
What is the SMILES notation for 2-(4-tert-butylphenoxy)ethanol;1-[2-(3-tert-butylphenoxy)ethyl]pyrrolidine;1-[2-(4-tert-butylphenoxy)ethyl]pyrrolidine;1-(4-tert-butylphenyl)imidazole;4-[(4-tert-butylphenyl)methyl]morpholine;1-[(3-tert-butylphenyl)methyl]piperazine;1-(4-tert-butylphenyl)-4-methylpiperazine;1-[(4-tert-butylphenyl)methyl]pyrazole;1-(3-tert-butylphenyl)piperazine;4-(4-tert-butylphenyl)sulfonylpiperidine;4-tert-butyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide?
The canonical SMILES for 2-(4-tert-butylphenoxy)ethanol;1-[2-(3-tert-butylphenoxy)ethyl]pyrrolidine;1-[2-(4-tert-butylphenoxy)ethyl]pyrrolidine;1-(4-tert-butylphenyl)imidazole;4-[(4-tert-butylphenyl)methyl]morpholine;1-[(3-tert-butylphenyl)methyl]piperazine;1-(4-tert-butylphenyl)-4-methylpiperazine;1-[(4-tert-butylphenyl)methyl]pyrazole;1-(3-tert-butylphenyl)piperazine;4-(4-tert-butylphenyl)sulfonylpiperidine;4-tert-butyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide is CC(C)(C)c1ccc(-n2ccnc2)cc1.CC(C)(C)c1ccc(CN2CCOCC2)cc1.CC(C)(C)c1ccc(Cn2cccn2)cc1.CC(C)(C)c1ccc(OCCN2CCCC2)cc1.CC(C)(C)c1ccc(OCCO)cc1.CC(C)(C)c1ccc(S(=O)(=O)C2CCNCC2)cc1.CC(C)(C)c1ccc(S(=O)(=O)NCCN2CCCC2)cc1.CC(C)(C)c1cccc(CN2CCNCC2)c1.CC(C)(C)c1cccc(N2CCNCC2)c1.CC(C)(C)c1cccc(OCCN2CCCC2)c1.CN1CCN(c2ccc(C(C)(C)C)cc2)CC1.
What is the InChIKey of 2-(4-tert-butylphenoxy)ethanol;1-[2-(3-tert-butylphenoxy)ethyl]pyrrolidine;1-[2-(4-tert-butylphenoxy)ethyl]pyrrolidine;1-(4-tert-butylphenyl)imidazole;4-[(4-tert-butylphenyl)methyl]morpholine;1-[(3-tert-butylphenyl)methyl]piperazine;1-(4-tert-butylphenyl)-4-methylpiperazine;1-[(4-tert-butylphenyl)methyl]pyrazole;1-(3-tert-butylphenyl)piperazine;4-(4-tert-butylphenyl)sulfonylpiperidine;4-tert-butyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide?
The InChIKey is JDCKYXCTLKPCOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2S.2C16H25NO.2C15H24N2.C15H23NO2S.C15H23NO.C14H18N2.C14H22N2.C13H16N2.C12H18O2/c1-16(2,3)14-6-8-15(9-7-14)21(19,20)17-10-13-18-11-4-5-12-18;1-16(2,3)14-6-8-15(9-7-14)18-13-12-17-10-4-5-11-17;1-16(2,3)14-7-6-8-15(13-14)18-12-11-17-9-4-5-10-17;1-15(2,3)13-5-7-14(8-6-13)17-11-9-16(4)10-12-17;1-15(2,3)14-6-4-5-13(11-14)12-17-9-7-16-8-10-17;1-15(2,3)12-4-6-13(7-5-12)19(17,18)14-8-10-16-11-9-14;1-15(2,3)14-6-4-13(5-7-14)12-16-8-10-17-11-9-16;1-14(2,3)13-7-5-12(6-8-13)11-16-10-4-9-15-16;1-14(2,3)12-5-4-6-13(11-12)16-9-7-15-8-10-16;1-13(2,3)11-4-6-12(7-5-11)15-9-8-14-10-15;1-12(2,3)10-4-6-11(7-5-10)14-9-8-13/h6-9,17H,4-5,10-13H2,1-3H3;6-9H,4-5,10-13H2,1-3H3;6-8,13H,4-5,9-12H2,1-3H3;5-8H,9-12H2,1-4H3;4-6,11,16H,7-10,12H2,1-3H3;4-7,14,16H,8-11H2,1-3H3;4-7H,8-12H2,1-3H3;4-10H,11H2,1-3H3;4-6,11,15H,7-10H2,1-3H3;4-10H,1-3H3;4-7,13H,8-9H2,1-3H3.
What are the key properties of 2-(4-tert-butylphenoxy)ethanol;1-[2-(3-tert-butylphenoxy)ethyl]pyrrolidine;1-[2-(4-tert-butylphenoxy)ethyl]pyrrolidine;1-(4-tert-butylphenyl)imidazole;4-[(4-tert-butylphenyl)methyl]morpholine;1-[(3-tert-butylphenyl)methyl]piperazine;1-(4-tert-butylphenyl)-4-methylpiperazine;1-[(4-tert-butylphenyl)methyl]pyrazole;1-(3-tert-butylphenyl)piperazine;4-(4-tert-butylphenyl)sulfonylpiperidine;4-tert-butyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide?
2-(4-tert-butylphenoxy)ethanol;1-[2-(3-tert-butylphenoxy)ethyl]pyrrolidine;1-[2-(4-tert-butylphenoxy)ethyl]pyrrolidine;1-(4-tert-butylphenyl)imidazole;4-[(4-tert-butylphenyl)methyl]morpholine;1-[(3-tert-butylphenyl)methyl]piperazine;1-(4-tert-butylphenyl)-4-methylpiperazine;1-[(4-tert-butylphenyl)methyl]pyrazole;1-(3-tert-butylphenyl)piperazine;4-(4-tert-butylphenyl)sulfonylpiperidine;4-tert-butyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide has a molecular weight of 2611.96 g/mol, XLogP of 30.87, 27 rotatable bonds, 5 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-tert-butylphenoxy)ethanol;1-[2-(3-tert-butylphenoxy)ethyl]pyrrolidine;1-[2-(4-tert-butylphenoxy)ethyl]pyrrolidine;1-(4-tert-butylphenyl)imidazole;4-[(4-tert-butylphenyl)methyl]morpholine;1-[(3-tert-butylphenyl)methyl]piperazine;1-(4-tert-butylphenyl)-4-methylpiperazine;1-[(4-tert-butylphenyl)methyl]pyrazole;1-(3-tert-butylphenyl)piperazine;4-(4-tert-butylphenyl)sulfonylpiperidine;4-tert-butyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide is sourced from PubChem (CID 158881701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).