4-tert-butyl-N,N-dimethylaniline;4-tert-butyl-2-fluoro-1-methoxybenzene;4-tert-butyl-2-fluoro-1-(2-methoxyethoxy)benzene;2-(4-tert-butyl-2-fluorophenoxy)ethanol;1-[2-(4-tert-butyl-2-fluorophenoxy)ethyl]piperidine;3-(4-tert-butyl-2-fluorophenyl)-N,N-dimethylpropan-1-amine;1-(4-tert-butyl-2-fluorophenyl)-4-methylpiperazine;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;4-tert-butyl-N-methylbenzamide;1-(4-tert-butyl-2-methylphenyl)-4-methylpiperazine;4-tert-butyl-1,2-oxazole;1-(4-tert-butylphenyl)-4-methylpiperazine;4-(4-tert-butylphenyl)morpholine;1-(4-tert-butylphenyl)piperidine

C196H297F6N13O11 — CID 162235239

IUPAC4-tert-butyl-N,N-dimethylaniline;4-tert-butyl-2-fluoro-1-methoxybenzene;4-tert-butyl-2-fluoro-1-(2-methoxyethoxy)benzene;2-(4-tert-butyl-2-fluorophenoxy)ethanol;1-[2-(4-tert-butyl-2-fluorophenoxy)ethyl]piperidine;3-(4-tert-butyl-2-fluorophenyl)-N,N-dimethylpropan-1-amine;1-(4-tert-butyl-2-fluorophenyl)-4-methylpiperazine;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;4-tert-butyl-N-methylbenzamide;1-(4-tert-butyl-2-methylphenyl)-4-methylpiperazine;4-tert-butyl-1,2-oxazole;1-(4-tert-butylphenyl)-4-methylpiperazine;4-(4-tert-butylphenyl)morpholine;1-(4-tert-butylphenyl)piperidine
SMILESCC(C)(C)c1ccc(N2CCCCC2)cc1.CC(C)(C)c1ccc(N2CCOCC2)cc1.CC(C)(C)c1ccc(OCCN2CCCCC2)c(F)c1.CC(C)(C)c1ccc(OCCO)c(F)c1.CC(C)(C)c1cnoc1.CN(C)CCCc1ccc(C(C)(C)C)cc1F.CN(C)c1ccc(C(C)(C)C)cc1.CN1CCN(c2ccc(C(C)(C)C)cc2)CC1.CN1CCN(c2ccc(C(C)(C)C)cc2F)CC1.CNC(=O)c1ccc(C(C)(C)C)cc1.COCCOc1ccc(C(C)(C)C)cc1F.COc1ccc(C(C)(C)C)cc1.COc1ccc(C(C)(C)C)cc1F.COc1cccc(C(C)(C)C)c1.Cc1cc(C(C)(C)C)ccc1N1CCN(C)CC1
InChIInChI=1S/C17H26FNO.C16H26N2.C15H23FN2.C15H24FN.C15H24N2.C15H23N.C14H21NO.C13H19FO2.C12H17FO2.C12H17NO.C12H19N.C11H15FO.2C11H16O.C7H11NO/c1-17(2,3)14-7-8-16(15(18)13-14)20-12-11-19-9-5-4-6-10-19;1-13-12-14(16(2,3)4)6-7-15(13)18-10-8-17(5)9-11-18;1-15(2,3)12-5-6-14(13(16)11-12)18-9-7-17(4)8-10-18;1-15(2,3)13-9-8-12(14(16)11-13)7-6-10-17(4)5;1-15(2,3)13-5-7-14(8-6-13)17-11-9-16(4)10-12-17;1-15(2,3)13-7-9-14(10-8-13)16-11-5-4-6-12-16;1-14(2,3)12-4-6-13(7-5-12)15-8-10-16-11-9-15;1-13(2,3)10-5-6-12(11(14)9-10)16-8-7-15-4;1-12(2,3)9-4-5-11(10(13)8-9)15-7-6-14;1-12(2,3)10-7-5-9(6-8-10)11(14)13-4;1-12(2,3)10-6-8-11(9-7-10)13(4)5;1-11(2,3)8-5-6-10(13-4)9(12)7-8;1-11(2,3)9-5-7-10(12-4)8-6-9;1-11(2,3)9-6-5-7-10(8-9)12-4;1-7(2,3)6-4-8-9-5-6/h7-8,13H,4-6,9-12H2,1-3H3;6-7,12H,8-11H2,1-5H3;5-6,11H,7-10H2,1-4H3;8-9,11H,6-7,10H2,1-5H3;5-8H,9-12H2,1-4H3;7-10H,4-6,11-12H2,1-3H3;4-7H,8-11H2,1-3H3;5-6,9H,7-8H2,1-4H3;4-5,8,14H,6-7H2,1-3H3;5-8H,1-4H3,(H,13,14);6-9H,1-5H3;5-7H,1-4H3;2*5-8H,1-4H3;4-5H,1-3H3
InChIKeyZVYWIVZICYJSBM-UHFFFAOYSA-N
MW3125.60 g/mol
LogP45.18
Rot. Bonds25

About 4-tert-butyl-N,N-dimethylaniline;4-tert-butyl-2-fluoro-1-methoxybenzene;4-tert-butyl-2-fluoro-1-(2-methoxyethoxy)benzene;2-(4-tert-butyl-2-fluorophenoxy)ethanol;1-[2-(4-tert-butyl-2-fluorophenoxy)ethyl]piperidine;3-(4-tert-butyl-2-fluorophenyl)-N,N-dimethylpropan-1-amine;1-(4-tert-butyl-2-fluorophenyl)-4-methylpiperazine;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;4-tert-butyl-N-methylbenzamide;1-(4-tert-butyl-2-methylphenyl)-4-methylpiperazine;4-tert-butyl-1,2-oxazole;1-(4-tert-butylphenyl)-4-methylpiperazine;4-(4-tert-butylphenyl)morpholine;1-(4-tert-butylphenyl)piperidine

4-tert-butyl-N,N-dimethylaniline;4-tert-butyl-2-fluoro-1-methoxybenzene;4-tert-butyl-2-fluoro-1-(2-methoxyethoxy)benzene;2-(4-tert-butyl-2-fluorophenoxy)ethanol;1-[2-(4-tert-butyl-2-fluorophenoxy)ethyl]piperidine;3-(4-tert-butyl-2-fluorophenyl)-N,N-dimethylpropan-1-amine;1-(4-tert-butyl-2-fluorophenyl)-4-methylpiperazine;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;4-tert-butyl-N-methylbenzamide;1-(4-tert-butyl-2-methylphenyl)-4-methylpiperazine;4-tert-butyl-1,2-oxazole;1-(4-tert-butylphenyl)-4-methylpiperazine;4-(4-tert-butylphenyl)morpholine;1-(4-tert-butylphenyl)piperidine (PubChem CID 162235239) has the molecular formula C196H297F6N13O11 and a molecular weight of 3125.60 g/mol. Its IUPAC name is 4-tert-butyl-N,N-dimethylaniline;4-tert-butyl-2-fluoro-1-methoxybenzene;4-tert-butyl-2-fluoro-1-(2-methoxyethoxy)benzene;2-(4-tert-butyl-2-fluorophenoxy)ethanol;1-[2-(4-tert-butyl-2-fluorophenoxy)ethyl]piperidine;3-(4-tert-butyl-2-fluorophenyl)-N,N-dimethylpropan-1-amine;1-(4-tert-butyl-2-fluorophenyl)-4-methylpiperazine;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;4-tert-butyl-N-methylbenzamide;1-(4-tert-butyl-2-methylphenyl)-4-methylpiperazine;4-tert-butyl-1,2-oxazole;1-(4-tert-butylphenyl)-4-methylpiperazine;4-(4-tert-butylphenyl)morpholine;1-(4-tert-butylphenyl)piperidine.

Molecular Properties

Compound Name4-tert-butyl-N,N-dimethylaniline;4-tert-butyl-2-fluoro-1-methoxybenzene;4-tert-butyl-2-fluoro-1-(2-methoxyethoxy)benzene;2-(4-tert-butyl-2-fluorophenoxy)ethanol;1-[2-(4-tert-butyl-2-fluorophenoxy)ethyl]piperidine;3-(4-tert-butyl-2-fluorophenyl)-N,N-dimethylpropan-1-amine;1-(4-tert-butyl-2-fluorophenyl)-4-methylpiperazine;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;4-tert-butyl-N-methylbenzamide;1-(4-tert-butyl-2-methylphenyl)-4-methylpiperazine;4-tert-butyl-1,2-oxazole;1-(4-tert-butylphenyl)-4-methylpiperazine;4-(4-tert-butylphenyl)morpholine;1-(4-tert-butylphenyl)piperidine
PubChem CID162235239
Molecular FormulaC196H297F6N13O11
Molecular Weight3125.60 g/mol
Exact Mass3123.30
IUPAC Name4-tert-butyl-N,N-dimethylaniline;4-tert-butyl-2-fluoro-1-methoxybenzene;4-tert-butyl-2-fluoro-1-(2-methoxyethoxy)benzene;2-(4-tert-butyl-2-fluorophenoxy)ethanol;1-[2-(4-tert-butyl-2-fluorophenoxy)ethyl]piperidine;3-(4-tert-butyl-2-fluorophenyl)-N,N-dimethylpropan-1-amine;1-(4-tert-butyl-2-fluorophenyl)-4-methylpiperazine;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;4-tert-butyl-N-methylbenzamide;1-(4-tert-butyl-2-methylphenyl)-4-methylpiperazine;4-tert-butyl-1,2-oxazole;1-(4-tert-butylphenyl)-4-methylpiperazine;4-(4-tert-butylphenyl)morpholine;1-(4-tert-butylphenyl)piperidine
SMILESCC(C)(C)c1ccc(N2CCCCC2)cc1.CC(C)(C)c1ccc(N2CCOCC2)cc1.CC(C)(C)c1ccc(OCCN2CCCCC2)c(F)c1.CC(C)(C)c1ccc(OCCO)c(F)c1.CC(C)(C)c1cnoc1.CN(C)CCCc1ccc(C(C)(C)C)cc1F.CN(C)c1ccc(C(C)(C)C)cc1.CN1CCN(c2ccc(C(C)(C)C)cc2)CC1.CN1CCN(c2ccc(C(C)(C)C)cc2F)CC1.CNC(=O)c1ccc(C(C)(C)C)cc1.COCCOc1ccc(C(C)(C)C)cc1F.COc1ccc(C(C)(C)C)cc1.COc1ccc(C(C)(C)C)cc1F.COc1cccc(C(C)(C)C)c1.Cc1cc(C(C)(C)C)ccc1N1CCN(C)CC1
InChIInChI=1S/C17H26FNO.C16H26N2.C15H23FN2.C15H24FN.C15H24N2.C15H23N.C14H21NO.C13H19FO2.C12H17FO2.C12H17NO.C12H19N.C11H15FO.2C11H16O.C7H11NO/c1-17(2,3)14-7-8-16(15(18)13-14)20-12-11-19-9-5-4-6-10-19;1-13-12-14(16(2,3)4)6-7-15(13)18-10-8-17(5)9-11-18;1-15(2,3)12-5-6-14(13(16)11-12)18-9-7-17(4)8-10-18;1-15(2,3)13-9-8-12(14(16)11-13)7-6-10-17(4)5;1-15(2,3)13-5-7-14(8-6-13)17-11-9-16(4)10-12-17;1-15(2,3)13-7-9-14(10-8-13)16-11-5-4-6-12-16;1-14(2,3)12-4-6-13(7-5-12)15-8-10-16-11-9-15;1-13(2,3)10-5-6-12(11(14)9-10)16-8-7-15-4;1-12(2,3)9-4-5-11(10(13)8-9)15-7-6-14;1-12(2,3)10-7-5-9(6-8-10)11(14)13-4;1-12(2,3)10-6-8-11(9-7-10)13(4)5;1-11(2,3)8-5-6-10(13-4)9(12)7-8;1-11(2,3)9-5-7-10(12-4)8-6-9;1-11(2,3)9-6-5-7-10(8-9)12-4;1-7(2,3)6-4-8-9-5-6/h7-8,13H,4-6,9-12H2,1-3H3;6-7,12H,8-11H2,1-5H3;5-6,11H,7-10H2,1-4H3;8-9,11H,6-7,10H2,1-5H3;5-8H,9-12H2,1-4H3;7-10H,4-6,11-12H2,1-3H3;4-7H,8-11H2,1-3H3;5-6,9H,7-8H2,1-4H3;4-5,8,14H,6-7H2,1-3H3;5-8H,1-4H3,(H,13,14);6-9H,1-5H3;5-7H,1-4H3;2*5-8H,1-4H3;4-5H,1-3H3
InChIKeyZVYWIVZICYJSBM-UHFFFAOYSA-N
XLogP45.18
TPSA184.84 Ų
H-Bond Donors2
H-Bond Acceptors23
Rotatable Bonds25
Heavy Atoms226
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003125.60
LogP ≤ 545.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

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

Analyze 4-tert-butyl-N,N-dimethylaniline;4-tert-butyl-2-fluoro-1-methoxybenzene;4-tert-butyl-2-fluoro-1-(2-methoxyethoxy)benzene;2-(4-tert-butyl-2-fluorophenoxy)ethanol;1-[2-(4-tert-butyl-2-fluorophenoxy)ethyl]piperidine;3-(4-tert-butyl-2-fluorophenyl)-N,N-dimethylpropan-1-amine;1-(4-tert-butyl-2-fluorophenyl)-4-methylpiperazine;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;4-tert-butyl-N-methylbenzamide;1-(4-tert-butyl-2-methylphenyl)-4-methylpiperazine;4-tert-butyl-1,2-oxazole;1-(4-tert-butylphenyl)-4-methylpiperazine;4-(4-tert-butylphenyl)morpholine;1-(4-tert-butylphenyl)piperidine with MolForge

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Related Compounds

1-tert-butyl-4-(2-methoxyethoxy)benzene;3-(4-tert-butylphenoxy)-N,N-dimethylpropan-1-amine;1-[2-(4-tert-butylphenoxy)ethyl]piperidine;1-[3-(4-tert-butylphenoxy)propyl]piperidine;1-[3-(4-tert-butylphenoxy)propyl]pyrrolidine;1-[3-(4-tert-butylphenoxy)propyl]triazole;1-(4-tert-butylphenyl)-4-methylpiperazine;4-(4-tert-butylphenyl)morpholine;3-(4-tert-butylphenyl)pyridine;4-(4-tert-butylphenyl)pyridine;1-(4-tert-butylphenyl)pyrrole
CID 159397303
N-[2-(1,3-benzothiazol-2-yl)-5-methoxyphenyl]-3-fluoro-4-(2-piperidin-1-ylethoxy)benzamide
CID 23087384
N-[2-amino-1-cyclopentyl-1-(4-methoxyphenyl)-2-oxoethyl]-3,4-dimethoxy-N-(2-morpholin-4-ylethyl)benzamide
CID 21156805
4-methoxy-N-(5-morpholin-4-yl-2-pyrrolidin-1-ylphenyl)benzamide
CID 110400402
1-tert-butylcyclopenta-1,3-diene;2-tert-butylfuran;1-tert-butyl-4-methoxybenzene;1-tert-butyl-3-nitrobenzene;4-tert-butylphenol;3-(4-tert-butylphenoxy)-N,N-diethylpropan-1-amine;3-(4-tert-butylphenoxy)-N,N-dimethylpropan-1-amine;1-[2-(4-tert-butylphenoxy)ethyl]-4-methylpiperazine;1-tert-butyl-4-phenylbenzene;4-[(4-tert-butylphenyl)methyl]morpholine;N-(3-tert-butylphenyl)-4-[(4-methylpiperazin-1-yl)methyl]benzamide;4-(4-tert-butylphenyl)morpholine
CID 159236702
3-fluoro-4-(2-morpholin-4-ylethoxy)benzoic acid
CID 107689816
6-[3-chloro-4-(4-oxopentoxy)phenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;6-[4-[3-(dimethylamino)propylamino]phenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;6-[3-fluoro-4-(3-methoxypropylamino)phenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;1-(4-methoxyphenyl)-6-[4-[3-(methylamino)propoxy]phenyl]-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;1-(4-methoxyphenyl)-6-[4-(4-methylpiperazin-1-yl)phenyl]-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide
CID 158511009
N-[(2R)-5-methoxy-8-(4-methylpiperazin-1-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-4-morpholin-4-ylbenzamide
CID 54462702
4-[2-(dimethylcarbamoyl)-4-methoxyphenoxy]-N-(2,6-dimethylphenyl)-2-[3-fluoro-4-[3-(4-methylpiperazin-1-yl)propoxy]anilino]pyrimidine-5-carboxamide
CID 11250989
(2,5-dimethoxyphenyl)-(4-morpholin-4-ylphenyl)methanone
CID 23913459
N-[2-hydroxy-6-[(4-methoxybenzoyl)amino]phenyl]-4-[4-(2-methoxyethyl)-1,4-diazepan-1-yl]benzamide;hydrochloride
CID 162338663
N-[2-methoxy-6-[(4-methoxybenzoyl)amino]phenyl]-4-(4-methyl-1,4-diazepan-1-yl)benzamide
CID 12972261

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N,N-dimethylaniline;4-tert-butyl-2-fluoro-1-methoxybenzene;4-tert-butyl-2-fluoro-1-(2-methoxyethoxy)benzene;2-(4-tert-butyl-2-fluorophenoxy)ethanol;1-[2-(4-tert-butyl-2-fluorophenoxy)ethyl]piperidine;3-(4-tert-butyl-2-fluorophenyl)-N,N-dimethylpropan-1-amine;1-(4-tert-butyl-2-fluorophenyl)-4-methylpiperazine;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;4-tert-butyl-N-methylbenzamide;1-(4-tert-butyl-2-methylphenyl)-4-methylpiperazine;4-tert-butyl-1,2-oxazole;1-(4-tert-butylphenyl)-4-methylpiperazine;4-(4-tert-butylphenyl)morpholine;1-(4-tert-butylphenyl)piperidine?
The IUPAC name of 4-tert-butyl-N,N-dimethylaniline;4-tert-butyl-2-fluoro-1-methoxybenzene;4-tert-butyl-2-fluoro-1-(2-methoxyethoxy)benzene;2-(4-tert-butyl-2-fluorophenoxy)ethanol;1-[2-(4-tert-butyl-2-fluorophenoxy)ethyl]piperidine;3-(4-tert-butyl-2-fluorophenyl)-N,N-dimethylpropan-1-amine;1-(4-tert-butyl-2-fluorophenyl)-4-methylpiperazine;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;4-tert-butyl-N-methylbenzamide;1-(4-tert-butyl-2-methylphenyl)-4-methylpiperazine;4-tert-butyl-1,2-oxazole;1-(4-tert-butylphenyl)-4-methylpiperazine;4-(4-tert-butylphenyl)morpholine;1-(4-tert-butylphenyl)piperidine (CID 162235239) is 4-tert-butyl-N,N-dimethylaniline;4-tert-butyl-2-fluoro-1-methoxybenzene;4-tert-butyl-2-fluoro-1-(2-methoxyethoxy)benzene;2-(4-tert-butyl-2-fluorophenoxy)ethanol;1-[2-(4-tert-butyl-2-fluorophenoxy)ethyl]piperidine;3-(4-tert-butyl-2-fluorophenyl)-N,N-dimethylpropan-1-amine;1-(4-tert-butyl-2-fluorophenyl)-4-methylpiperazine;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;4-tert-butyl-N-methylbenzamide;1-(4-tert-butyl-2-methylphenyl)-4-methylpiperazine;4-tert-butyl-1,2-oxazole;1-(4-tert-butylphenyl)-4-methylpiperazine;4-(4-tert-butylphenyl)morpholine;1-(4-tert-butylphenyl)piperidine.
What is the SMILES notation for 4-tert-butyl-N,N-dimethylaniline;4-tert-butyl-2-fluoro-1-methoxybenzene;4-tert-butyl-2-fluoro-1-(2-methoxyethoxy)benzene;2-(4-tert-butyl-2-fluorophenoxy)ethanol;1-[2-(4-tert-butyl-2-fluorophenoxy)ethyl]piperidine;3-(4-tert-butyl-2-fluorophenyl)-N,N-dimethylpropan-1-amine;1-(4-tert-butyl-2-fluorophenyl)-4-methylpiperazine;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;4-tert-butyl-N-methylbenzamide;1-(4-tert-butyl-2-methylphenyl)-4-methylpiperazine;4-tert-butyl-1,2-oxazole;1-(4-tert-butylphenyl)-4-methylpiperazine;4-(4-tert-butylphenyl)morpholine;1-(4-tert-butylphenyl)piperidine?
The canonical SMILES for 4-tert-butyl-N,N-dimethylaniline;4-tert-butyl-2-fluoro-1-methoxybenzene;4-tert-butyl-2-fluoro-1-(2-methoxyethoxy)benzene;2-(4-tert-butyl-2-fluorophenoxy)ethanol;1-[2-(4-tert-butyl-2-fluorophenoxy)ethyl]piperidine;3-(4-tert-butyl-2-fluorophenyl)-N,N-dimethylpropan-1-amine;1-(4-tert-butyl-2-fluorophenyl)-4-methylpiperazine;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;4-tert-butyl-N-methylbenzamide;1-(4-tert-butyl-2-methylphenyl)-4-methylpiperazine;4-tert-butyl-1,2-oxazole;1-(4-tert-butylphenyl)-4-methylpiperazine;4-(4-tert-butylphenyl)morpholine;1-(4-tert-butylphenyl)piperidine is CC(C)(C)c1ccc(N2CCCCC2)cc1.CC(C)(C)c1ccc(N2CCOCC2)cc1.CC(C)(C)c1ccc(OCCN2CCCCC2)c(F)c1.CC(C)(C)c1ccc(OCCO)c(F)c1.CC(C)(C)c1cnoc1.CN(C)CCCc1ccc(C(C)(C)C)cc1F.CN(C)c1ccc(C(C)(C)C)cc1.CN1CCN(c2ccc(C(C)(C)C)cc2)CC1.CN1CCN(c2ccc(C(C)(C)C)cc2F)CC1.CNC(=O)c1ccc(C(C)(C)C)cc1.COCCOc1ccc(C(C)(C)C)cc1F.COc1ccc(C(C)(C)C)cc1.COc1ccc(C(C)(C)C)cc1F.COc1cccc(C(C)(C)C)c1.Cc1cc(C(C)(C)C)ccc1N1CCN(C)CC1.
What is the InChIKey of 4-tert-butyl-N,N-dimethylaniline;4-tert-butyl-2-fluoro-1-methoxybenzene;4-tert-butyl-2-fluoro-1-(2-methoxyethoxy)benzene;2-(4-tert-butyl-2-fluorophenoxy)ethanol;1-[2-(4-tert-butyl-2-fluorophenoxy)ethyl]piperidine;3-(4-tert-butyl-2-fluorophenyl)-N,N-dimethylpropan-1-amine;1-(4-tert-butyl-2-fluorophenyl)-4-methylpiperazine;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;4-tert-butyl-N-methylbenzamide;1-(4-tert-butyl-2-methylphenyl)-4-methylpiperazine;4-tert-butyl-1,2-oxazole;1-(4-tert-butylphenyl)-4-methylpiperazine;4-(4-tert-butylphenyl)morpholine;1-(4-tert-butylphenyl)piperidine?
The InChIKey is ZVYWIVZICYJSBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26FNO.C16H26N2.C15H23FN2.C15H24FN.C15H24N2.C15H23N.C14H21NO.C13H19FO2.C12H17FO2.C12H17NO.C12H19N.C11H15FO.2C11H16O.C7H11NO/c1-17(2,3)14-7-8-16(15(18)13-14)20-12-11-19-9-5-4-6-10-19;1-13-12-14(16(2,3)4)6-7-15(13)18-10-8-17(5)9-11-18;1-15(2,3)12-5-6-14(13(16)11-12)18-9-7-17(4)8-10-18;1-15(2,3)13-9-8-12(14(16)11-13)7-6-10-17(4)5;1-15(2,3)13-5-7-14(8-6-13)17-11-9-16(4)10-12-17;1-15(2,3)13-7-9-14(10-8-13)16-11-5-4-6-12-16;1-14(2,3)12-4-6-13(7-5-12)15-8-10-16-11-9-15;1-13(2,3)10-5-6-12(11(14)9-10)16-8-7-15-4;1-12(2,3)9-4-5-11(10(13)8-9)15-7-6-14;1-12(2,3)10-7-5-9(6-8-10)11(14)13-4;1-12(2,3)10-6-8-11(9-7-10)13(4)5;1-11(2,3)8-5-6-10(13-4)9(12)7-8;1-11(2,3)9-5-7-10(12-4)8-6-9;1-11(2,3)9-6-5-7-10(8-9)12-4;1-7(2,3)6-4-8-9-5-6/h7-8,13H,4-6,9-12H2,1-3H3;6-7,12H,8-11H2,1-5H3;5-6,11H,7-10H2,1-4H3;8-9,11H,6-7,10H2,1-5H3;5-8H,9-12H2,1-4H3;7-10H,4-6,11-12H2,1-3H3;4-7H,8-11H2,1-3H3;5-6,9H,7-8H2,1-4H3;4-5,8,14H,6-7H2,1-3H3;5-8H,1-4H3,(H,13,14);6-9H,1-5H3;5-7H,1-4H3;2*5-8H,1-4H3;4-5H,1-3H3.
What are the key properties of 4-tert-butyl-N,N-dimethylaniline;4-tert-butyl-2-fluoro-1-methoxybenzene;4-tert-butyl-2-fluoro-1-(2-methoxyethoxy)benzene;2-(4-tert-butyl-2-fluorophenoxy)ethanol;1-[2-(4-tert-butyl-2-fluorophenoxy)ethyl]piperidine;3-(4-tert-butyl-2-fluorophenyl)-N,N-dimethylpropan-1-amine;1-(4-tert-butyl-2-fluorophenyl)-4-methylpiperazine;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;4-tert-butyl-N-methylbenzamide;1-(4-tert-butyl-2-methylphenyl)-4-methylpiperazine;4-tert-butyl-1,2-oxazole;1-(4-tert-butylphenyl)-4-methylpiperazine;4-(4-tert-butylphenyl)morpholine;1-(4-tert-butylphenyl)piperidine?
4-tert-butyl-N,N-dimethylaniline;4-tert-butyl-2-fluoro-1-methoxybenzene;4-tert-butyl-2-fluoro-1-(2-methoxyethoxy)benzene;2-(4-tert-butyl-2-fluorophenoxy)ethanol;1-[2-(4-tert-butyl-2-fluorophenoxy)ethyl]piperidine;3-(4-tert-butyl-2-fluorophenyl)-N,N-dimethylpropan-1-amine;1-(4-tert-butyl-2-fluorophenyl)-4-methylpiperazine;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;4-tert-butyl-N-methylbenzamide;1-(4-tert-butyl-2-methylphenyl)-4-methylpiperazine;4-tert-butyl-1,2-oxazole;1-(4-tert-butylphenyl)-4-methylpiperazine;4-(4-tert-butylphenyl)morpholine;1-(4-tert-butylphenyl)piperidine has a molecular weight of 3125.60 g/mol, XLogP of 45.18, 25 rotatable bonds, 2 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-N,N-dimethylaniline;4-tert-butyl-2-fluoro-1-methoxybenzene;4-tert-butyl-2-fluoro-1-(2-methoxyethoxy)benzene;2-(4-tert-butyl-2-fluorophenoxy)ethanol;1-[2-(4-tert-butyl-2-fluorophenoxy)ethyl]piperidine;3-(4-tert-butyl-2-fluorophenyl)-N,N-dimethylpropan-1-amine;1-(4-tert-butyl-2-fluorophenyl)-4-methylpiperazine;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;4-tert-butyl-N-methylbenzamide;1-(4-tert-butyl-2-methylphenyl)-4-methylpiperazine;4-tert-butyl-1,2-oxazole;1-(4-tert-butylphenyl)-4-methylpiperazine;4-(4-tert-butylphenyl)morpholine;1-(4-tert-butylphenyl)piperidine is sourced from PubChem (CID 162235239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).