4-tert-butyl-2-(cyclobutylmethyl)pyridine;4-tert-butyl-2-(oxan-4-ylmethyl)pyridine;4-tert-butyl-6-(oxan-4-ylmethyl)pyrimidine;3-(4-tert-butylphenoxy)-1-propan-2-ylpyrrolidine;1-[3-(4-tert-butylphenoxy)pyrrolidin-1-yl]ethanone;2-[(3-tert-butylphenyl)methyl-methylamino]acetamide;4-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]-N,N-dimethylbutanamide;4-tert-butyl-2-(2-pyridin-2-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-3-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-4-ylethyl)pyridine

C159H233N17O7 — CID 157211842

IUPAC4-tert-butyl-2-(cyclobutylmethyl)pyridine;4-tert-butyl-2-(oxan-4-ylmethyl)pyridine;4-tert-butyl-6-(oxan-4-ylmethyl)pyrimidine;3-(4-tert-butylphenoxy)-1-propan-2-ylpyrrolidine;1-[3-(4-tert-butylphenoxy)pyrrolidin-1-yl]ethanone;2-[(3-tert-butylphenyl)methyl-methylamino]acetamide;4-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]-N,N-dimethylbutanamide;4-tert-butyl-2-(2-pyridin-2-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-3-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-4-ylethyl)pyridine
SMILESCC(=O)N1CCC(Oc2ccc(C(C)(C)C)cc2)C1.CC(C)(C)c1cc(CC2CCOCC2)ncn1.CC(C)(C)c1ccnc(CC2CCC2)c1.CC(C)(C)c1ccnc(CC2CCOCC2)c1.CC(C)(C)c1ccnc(CCc2ccccn2)c1.CC(C)(C)c1ccnc(CCc2cccnc2)c1.CC(C)(C)c1ccnc(CCc2ccncc2)c1.CC(C)N1CCC(Oc2ccc(C(C)(C)C)cc2)C1.CN(C)C(=O)CCCN1CCN(Cc2cccc(C(C)(C)C)c2)CC1.CN(CC(N)=O)Cc1cccc(C(C)(C)C)c1
InChIInChI=1S/C21H35N3O.C17H27NO.3C16H20N2.C16H23NO2.C15H23NO.2C14H22N2O.C14H21N/c1-21(2,3)19-9-6-8-18(16-19)17-24-14-12-23(13-15-24)11-7-10-20(25)22(4)5;1-13(2)18-11-10-16(12-18)19-15-8-6-14(7-9-15)17(3,4)5;1-16(2,3)14-8-11-18-15(12-14)5-4-13-6-9-17-10-7-13;1-16(2,3)14-8-10-18-15(11-14)7-6-13-5-4-9-17-12-13;1-16(2,3)13-9-11-18-15(12-13)8-7-14-6-4-5-10-17-14;1-12(18)17-10-9-15(11-17)19-14-7-5-13(6-8-14)16(2,3)4;1-15(2,3)13-4-7-16-14(11-13)10-12-5-8-17-9-6-12;1-14(2,3)13-9-12(15-10-16-13)8-11-4-6-17-7-5-11;1-14(2,3)12-7-5-6-11(8-12)9-16(4)10-13(15)17;1-14(2,3)12-7-8-15-13(10-12)9-11-5-4-6-11/h6,8-9,16H,7,10-15,17H2,1-5H3;6-9,13,16H,10-12H2,1-5H3;6-12H,4-5H2,1-3H3;4-5,8-12H,6-7H2,1-3H3;4-6,9-12H,7-8H2,1-3H3;5-8,15H,9-11H2,1-4H3;4,7,11-12H,5-6,8-10H2,1-3H3;9-11H,4-8H2,1-3H3;5-8H,9-10H2,1-4H3,(H2,15,17);7-8,10-11H,4-6,9H2,1-3H3
InChIKeyARZCFERZSBXZPM-UHFFFAOYSA-N
MW2494.72 g/mol
LogP32.19
Rot. Bonds30

About 4-tert-butyl-2-(cyclobutylmethyl)pyridine;4-tert-butyl-2-(oxan-4-ylmethyl)pyridine;4-tert-butyl-6-(oxan-4-ylmethyl)pyrimidine;3-(4-tert-butylphenoxy)-1-propan-2-ylpyrrolidine;1-[3-(4-tert-butylphenoxy)pyrrolidin-1-yl]ethanone;2-[(3-tert-butylphenyl)methyl-methylamino]acetamide;4-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]-N,N-dimethylbutanamide;4-tert-butyl-2-(2-pyridin-2-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-3-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-4-ylethyl)pyridine

4-tert-butyl-2-(cyclobutylmethyl)pyridine;4-tert-butyl-2-(oxan-4-ylmethyl)pyridine;4-tert-butyl-6-(oxan-4-ylmethyl)pyrimidine;3-(4-tert-butylphenoxy)-1-propan-2-ylpyrrolidine;1-[3-(4-tert-butylphenoxy)pyrrolidin-1-yl]ethanone;2-[(3-tert-butylphenyl)methyl-methylamino]acetamide;4-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]-N,N-dimethylbutanamide;4-tert-butyl-2-(2-pyridin-2-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-3-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-4-ylethyl)pyridine (PubChem CID 157211842) has the molecular formula C159H233N17O7 and a molecular weight of 2494.72 g/mol. Its IUPAC name is 4-tert-butyl-2-(cyclobutylmethyl)pyridine;4-tert-butyl-2-(oxan-4-ylmethyl)pyridine;4-tert-butyl-6-(oxan-4-ylmethyl)pyrimidine;3-(4-tert-butylphenoxy)-1-propan-2-ylpyrrolidine;1-[3-(4-tert-butylphenoxy)pyrrolidin-1-yl]ethanone;2-[(3-tert-butylphenyl)methyl-methylamino]acetamide;4-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]-N,N-dimethylbutanamide;4-tert-butyl-2-(2-pyridin-2-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-3-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-4-ylethyl)pyridine.

Molecular Properties

Compound Name4-tert-butyl-2-(cyclobutylmethyl)pyridine;4-tert-butyl-2-(oxan-4-ylmethyl)pyridine;4-tert-butyl-6-(oxan-4-ylmethyl)pyrimidine;3-(4-tert-butylphenoxy)-1-propan-2-ylpyrrolidine;1-[3-(4-tert-butylphenoxy)pyrrolidin-1-yl]ethanone;2-[(3-tert-butylphenyl)methyl-methylamino]acetamide;4-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]-N,N-dimethylbutanamide;4-tert-butyl-2-(2-pyridin-2-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-3-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-4-ylethyl)pyridine
PubChem CID157211842
Molecular FormulaC159H233N17O7
Molecular Weight2494.72 g/mol
Exact Mass2492.84
IUPAC Name4-tert-butyl-2-(cyclobutylmethyl)pyridine;4-tert-butyl-2-(oxan-4-ylmethyl)pyridine;4-tert-butyl-6-(oxan-4-ylmethyl)pyrimidine;3-(4-tert-butylphenoxy)-1-propan-2-ylpyrrolidine;1-[3-(4-tert-butylphenoxy)pyrrolidin-1-yl]ethanone;2-[(3-tert-butylphenyl)methyl-methylamino]acetamide;4-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]-N,N-dimethylbutanamide;4-tert-butyl-2-(2-pyridin-2-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-3-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-4-ylethyl)pyridine
SMILESCC(=O)N1CCC(Oc2ccc(C(C)(C)C)cc2)C1.CC(C)(C)c1cc(CC2CCOCC2)ncn1.CC(C)(C)c1ccnc(CC2CCC2)c1.CC(C)(C)c1ccnc(CC2CCOCC2)c1.CC(C)(C)c1ccnc(CCc2ccccn2)c1.CC(C)(C)c1ccnc(CCc2cccnc2)c1.CC(C)(C)c1ccnc(CCc2ccncc2)c1.CC(C)N1CCC(Oc2ccc(C(C)(C)C)cc2)C1.CN(C)C(=O)CCCN1CCN(Cc2cccc(C(C)(C)C)c2)CC1.CN(CC(N)=O)Cc1cccc(C(C)(C)C)c1
InChIInChI=1S/C21H35N3O.C17H27NO.3C16H20N2.C16H23NO2.C15H23NO.2C14H22N2O.C14H21N/c1-21(2,3)19-9-6-8-18(16-19)17-24-14-12-23(13-15-24)11-7-10-20(25)22(4)5;1-13(2)18-11-10-16(12-18)19-15-8-6-14(7-9-15)17(3,4)5;1-16(2,3)14-8-11-18-15(12-14)5-4-13-6-9-17-10-7-13;1-16(2,3)14-8-10-18-15(11-14)7-6-13-5-4-9-17-12-13;1-16(2,3)13-9-11-18-15(12-13)8-7-14-6-4-5-10-17-14;1-12(18)17-10-9-15(11-17)19-14-7-5-13(6-8-14)16(2,3)4;1-15(2,3)13-4-7-16-14(11-13)10-12-5-8-17-9-6-12;1-14(2,3)13-9-12(15-10-16-13)8-11-4-6-17-7-5-11;1-14(2,3)12-7-5-6-11(8-12)9-16(4)10-13(15)17;1-14(2,3)12-7-8-15-13(10-12)9-11-5-4-6-11/h6,8-9,16H,7,10-15,17H2,1-5H3;6-9,13,16H,10-12H2,1-5H3;6-12H,4-5H2,1-3H3;4-5,8-12H,6-7H2,1-3H3;4-6,9-12H,7-8H2,1-3H3;5-8,15H,9-11H2,1-4H3;4,7,11-12H,5-6,8-10H2,1-3H3;9-11H,4-8H2,1-3H3;5-8H,9-10H2,1-4H3,(H2,15,17);7-8,10-11H,4-6,9H2,1-3H3
InChIKeyARZCFERZSBXZPM-UHFFFAOYSA-N
XLogP32.19
TPSA262.49 Ų
H-Bond Donors1
H-Bond Acceptors21
Rotatable Bonds30
Heavy Atoms183
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002494.72
LogP ≤ 532.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1021

Analyze 4-tert-butyl-2-(cyclobutylmethyl)pyridine;4-tert-butyl-2-(oxan-4-ylmethyl)pyridine;4-tert-butyl-6-(oxan-4-ylmethyl)pyrimidine;3-(4-tert-butylphenoxy)-1-propan-2-ylpyrrolidine;1-[3-(4-tert-butylphenoxy)pyrrolidin-1-yl]ethanone;2-[(3-tert-butylphenyl)methyl-methylamino]acetamide;4-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]-N,N-dimethylbutanamide;4-tert-butyl-2-(2-pyridin-2-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-3-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-4-ylethyl)pyridine with MolForge

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Launch Full Analysis

Related Compounds

4-tert-butyl-2-(cyclobutylmethyl)pyridine;4-tert-butyl-2-(2-cyclopropylethyl)pyridine;3-tert-butyl-5-(oxan-4-yloxy)pyridine;3-(4-tert-butylphenoxy)-1-propan-2-ylpyrrolidine;1-[(3-tert-butylphenyl)methyl-methylamino]propan-2-one;4-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]-N,N-dimethylbutanamide;4-tert-butyl-2-(2-pyridin-2-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-3-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-4-ylethyl)pyridine;N'-(4-tert-butyl-2-pyridinyl)-N,N,N'-trimethylethane-1,2-diamine;4-tert-butyl-6-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]pyrimidine;methane
CID 157271261
2-[[6-[2-[4-(1,1-Difluoroethyl)-3-fluorophenyl]pyrrolidin-1-yl]-5-fluoropyrimidin-4-yl]amino]-4,4-dimethylpentanamide;5-fluoro-4-[2-[3-fluoro-4-(trifluoromethyl)phenyl]pyrrolidin-1-yl]-6-[(6-methyl-3-pyridinyl)methoxy]pyrimidine;5-fluoro-4-[(6-methyl-3-pyridinyl)methoxy]-6-[2-[4-(trifluoromethyl)phenyl]pyrrolidin-1-yl]pyrimidine;1-[2-[1-[[5-fluoro-6-[2-[4-(trifluoromethyl)phenyl]pyrrolidin-1-yl]pyrimidin-4-yl]amino]-3,3-dimethylbutyl]morpholin-4-yl]ethanone
CID 158373840
4-tert-butyl-2-(oxan-4-ylmethyl)pyridine;4-tert-butyl-6-(oxan-4-ylmethyl)pyrimidine;3-(4-tert-butylphenoxy)-1-methylsulfonylpyrrolidine;3-(4-tert-butylphenoxy)-1-propan-2-ylpyrrolidine;1-[3-(4-tert-butylphenoxy)pyrrolidin-1-yl]ethanone;3-(4-tert-butylphenoxy)-1-(2,2,2-trifluoroethyl)pyrrolidine;2-[(3-tert-butylphenyl)methyl-methylamino]acetamide;4-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]-N,N-dimethylbutanamide;4-tert-butyl-2-(2-pyridin-2-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-3-ylethyl)pyridine
CID 158943256
4-tert-butyl-2-(oxan-4-ylmethyl)pyridine;4-tert-butyl-6-(oxan-4-ylmethyl)pyrimidine;3-(4-tert-butylphenoxy)-1-methylsulfonylpyrrolidine;3-(4-tert-butylphenoxy)-1-propan-2-ylpyrrolidine;1-[3-(4-tert-butylphenoxy)pyrrolidin-1-yl]ethanone;3-(4-tert-butylphenoxy)-1-(2,2,2-trifluoroethyl)pyrrolidine;2-[(3-tert-butylphenyl)methyl-methylamino]acetamide;4-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]-N,N-dimethylbutanamide;4-tert-butyl-2-(piperidin-4-ylmethyl)pyridine;4-tert-butyl-2-(2-pyridin-2-ylethyl)pyridine;4-tert-butyl-2-(pyrrolidin-3-ylmethyl)pyridine
CID 159669560
4-tert-butyl-2-(1-methylpiperidin-4-yl)oxypyridine;4-tert-butyl-6-(oxan-4-ylmethyl)pyrimidine;3-(4-tert-butylphenoxy)-1-methylsulfonylpyrrolidine;3-(4-tert-butylphenoxy)-1-propan-2-ylpyrrolidine;1-[3-(4-tert-butylphenoxy)pyrrolidin-1-yl]ethanone;3-(4-tert-butylphenoxy)-1-(2,2,2-trifluoroethyl)pyrrolidine;1-[(3-tert-butylphenyl)methyl-methylamino]propan-2-one;4-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]-N,N-dimethylbutanamide;4-tert-butyl-2-(piperidin-4-ylmethyl)pyridine;4-tert-butyl-2-(pyrrolidin-3-ylmethyl)pyridine
CID 160065191
4-tert-butyl-6-(oxan-4-ylmethyl)pyrimidine;3-(4-tert-butylphenoxy)-1-methylsulfonylpyrrolidine;3-(4-tert-butylphenoxy)-1-propan-2-ylpyrrolidine;1-[3-(4-tert-butylphenoxy)pyrrolidin-1-yl]ethanone;3-(4-tert-butylphenoxy)-1-(2,2,2-trifluoroethyl)pyrrolidine;2-[(3-tert-butylphenyl)methyl-methylamino]acetamide;4-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]-N,N-dimethylbutanamide;4-tert-butyl-2-(piperidin-4-ylmethyl)pyridine;4-tert-butyl-2-(pyrrolidin-3-ylmethyl)pyridine
CID 160402917
4-tert-butyl-2-(cyclobutylmethyl)pyridine;4-tert-butyl-2-(2-cyclopropylethyl)pyridine;4-tert-butyl-6-[(1-methylpyrrolidin-3-yl)methyl]pyrimidine;4-tert-butyl-2-(oxan-4-ylmethyl)pyridine;4-tert-butyl-6-(oxan-4-ylmethyl)pyrimidine;3-tert-butyl-5-(oxan-4-yloxy)pyridine;4-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]-N,N-dimethylbutanamide;4-tert-butyl-6-(piperidin-4-ylmethyl)pyrimidine;4-tert-butyl-2-(2-pyridin-2-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-3-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-4-ylethyl)pyridine;N'-(5-tert-butyl-3-pyridinyl)-N,N,N'-trimethylethane-1,2-diamine;4-tert-butyl-6-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]pyrimidine
CID 160536337
4-tert-butyl-2-(oxan-4-ylmethyl)pyridine;4-tert-butyl-6-(oxan-4-ylmethyl)pyrimidine;3-(4-tert-butylphenoxy)-1-methylsulfonylpyrrolidine;3-(4-tert-butylphenoxy)-1-propan-2-ylpyrrolidine;1-[3-(4-tert-butylphenoxy)pyrrolidin-1-yl]ethanone;3-(4-tert-butylphenoxy)-1-(2,2,2-trifluoroethyl)pyrrolidine;2-[(3-tert-butylphenyl)methyl-methylamino]acetamide;4-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]-N,N-dimethylbutanamide;4-tert-butyl-2-(piperidin-4-ylmethyl)pyridine;4-tert-butyl-2-(pyrrolidin-3-ylmethyl)pyridine
CID 160595346
4-tert-butyl-6-[(1-methylpiperidin-4-yl)methyl]pyrimidine;4-tert-butyl-2-(1-methylsulfonylpiperidin-4-yl)oxypyridine;3-tert-butyl-5-(oxolan-3-ylmethyl)pyridine;(3S)-4-[(3-tert-butylphenyl)methyl]-3-methyloxane;(3R)-4-[(3-tert-butylphenyl)methyl]-3-methyloxane;bis(1-[4-[(4-tert-butyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone);1-[4-[(6-tert-butylpyrimidin-4-yl)amino]piperidin-1-yl]ethanone;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]pyrrolidin-1-yl]ethanone;4-tert-butyl-6-(pyrrolidin-3-ylmethyl)pyrimidine;4-tert-butyl-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]oxypyridine
CID 160776065
4-tert-butyl-2-(oxan-4-ylmethyl)pyridine;4-tert-butyl-6-(oxan-4-ylmethyl)pyrimidine;3-(4-tert-butylphenoxy)-1-methylsulfonylpyrrolidine;3-(4-tert-butylphenoxy)-1-propan-2-ylpyrrolidine;1-[3-(4-tert-butylphenoxy)pyrrolidin-1-yl]ethanone;3-(4-tert-butylphenoxy)-1-(2,2,2-trifluoroethyl)pyrrolidine;2-[(3-tert-butylphenyl)methyl-methylamino]acetamide;4-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]-N,N-dimethylbutanamide;4-tert-butyl-2-(2-pyridin-2-ylethyl)pyridine
CID 161739513
2-[3-fluoro-3-methyl-1-[(2S)-5-oxopyrrolidine-2-carbonyl]piperidin-4-yl]oxy-5-[2-[[6-methoxy-5-[4-(oxetan-3-yl)piperazin-1-yl]-2-pyridinyl]amino]pyrimidin-4-yl]benzonitrile
CID 142561976
4-N-[4-(3-tert-butyl-4-propan-2-yloxyphenyl)pyrimidin-2-yl]cyclohexane-1,4-diamine;4-[4-(3-tert-butyl-4-propan-2-yloxyphenyl)pyrimidin-2-yl]piperazin-2-one;2-[4-[4-(3-tert-butyl-4-propan-2-yloxyphenyl)pyrimidin-2-yl]piperazin-1-yl]ethanol
CID 88314060

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-2-(cyclobutylmethyl)pyridine;4-tert-butyl-2-(oxan-4-ylmethyl)pyridine;4-tert-butyl-6-(oxan-4-ylmethyl)pyrimidine;3-(4-tert-butylphenoxy)-1-propan-2-ylpyrrolidine;1-[3-(4-tert-butylphenoxy)pyrrolidin-1-yl]ethanone;2-[(3-tert-butylphenyl)methyl-methylamino]acetamide;4-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]-N,N-dimethylbutanamide;4-tert-butyl-2-(2-pyridin-2-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-3-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-4-ylethyl)pyridine?
The IUPAC name of 4-tert-butyl-2-(cyclobutylmethyl)pyridine;4-tert-butyl-2-(oxan-4-ylmethyl)pyridine;4-tert-butyl-6-(oxan-4-ylmethyl)pyrimidine;3-(4-tert-butylphenoxy)-1-propan-2-ylpyrrolidine;1-[3-(4-tert-butylphenoxy)pyrrolidin-1-yl]ethanone;2-[(3-tert-butylphenyl)methyl-methylamino]acetamide;4-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]-N,N-dimethylbutanamide;4-tert-butyl-2-(2-pyridin-2-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-3-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-4-ylethyl)pyridine (CID 157211842) is 4-tert-butyl-2-(cyclobutylmethyl)pyridine;4-tert-butyl-2-(oxan-4-ylmethyl)pyridine;4-tert-butyl-6-(oxan-4-ylmethyl)pyrimidine;3-(4-tert-butylphenoxy)-1-propan-2-ylpyrrolidine;1-[3-(4-tert-butylphenoxy)pyrrolidin-1-yl]ethanone;2-[(3-tert-butylphenyl)methyl-methylamino]acetamide;4-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]-N,N-dimethylbutanamide;4-tert-butyl-2-(2-pyridin-2-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-3-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-4-ylethyl)pyridine.
What is the SMILES notation for 4-tert-butyl-2-(cyclobutylmethyl)pyridine;4-tert-butyl-2-(oxan-4-ylmethyl)pyridine;4-tert-butyl-6-(oxan-4-ylmethyl)pyrimidine;3-(4-tert-butylphenoxy)-1-propan-2-ylpyrrolidine;1-[3-(4-tert-butylphenoxy)pyrrolidin-1-yl]ethanone;2-[(3-tert-butylphenyl)methyl-methylamino]acetamide;4-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]-N,N-dimethylbutanamide;4-tert-butyl-2-(2-pyridin-2-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-3-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-4-ylethyl)pyridine?
The canonical SMILES for 4-tert-butyl-2-(cyclobutylmethyl)pyridine;4-tert-butyl-2-(oxan-4-ylmethyl)pyridine;4-tert-butyl-6-(oxan-4-ylmethyl)pyrimidine;3-(4-tert-butylphenoxy)-1-propan-2-ylpyrrolidine;1-[3-(4-tert-butylphenoxy)pyrrolidin-1-yl]ethanone;2-[(3-tert-butylphenyl)methyl-methylamino]acetamide;4-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]-N,N-dimethylbutanamide;4-tert-butyl-2-(2-pyridin-2-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-3-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-4-ylethyl)pyridine is CC(=O)N1CCC(Oc2ccc(C(C)(C)C)cc2)C1.CC(C)(C)c1cc(CC2CCOCC2)ncn1.CC(C)(C)c1ccnc(CC2CCC2)c1.CC(C)(C)c1ccnc(CC2CCOCC2)c1.CC(C)(C)c1ccnc(CCc2ccccn2)c1.CC(C)(C)c1ccnc(CCc2cccnc2)c1.CC(C)(C)c1ccnc(CCc2ccncc2)c1.CC(C)N1CCC(Oc2ccc(C(C)(C)C)cc2)C1.CN(C)C(=O)CCCN1CCN(Cc2cccc(C(C)(C)C)c2)CC1.CN(CC(N)=O)Cc1cccc(C(C)(C)C)c1.
What is the InChIKey of 4-tert-butyl-2-(cyclobutylmethyl)pyridine;4-tert-butyl-2-(oxan-4-ylmethyl)pyridine;4-tert-butyl-6-(oxan-4-ylmethyl)pyrimidine;3-(4-tert-butylphenoxy)-1-propan-2-ylpyrrolidine;1-[3-(4-tert-butylphenoxy)pyrrolidin-1-yl]ethanone;2-[(3-tert-butylphenyl)methyl-methylamino]acetamide;4-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]-N,N-dimethylbutanamide;4-tert-butyl-2-(2-pyridin-2-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-3-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-4-ylethyl)pyridine?
The InChIKey is ARZCFERZSBXZPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H35N3O.C17H27NO.3C16H20N2.C16H23NO2.C15H23NO.2C14H22N2O.C14H21N/c1-21(2,3)19-9-6-8-18(16-19)17-24-14-12-23(13-15-24)11-7-10-20(25)22(4)5;1-13(2)18-11-10-16(12-18)19-15-8-6-14(7-9-15)17(3,4)5;1-16(2,3)14-8-11-18-15(12-14)5-4-13-6-9-17-10-7-13;1-16(2,3)14-8-10-18-15(11-14)7-6-13-5-4-9-17-12-13;1-16(2,3)13-9-11-18-15(12-13)8-7-14-6-4-5-10-17-14;1-12(18)17-10-9-15(11-17)19-14-7-5-13(6-8-14)16(2,3)4;1-15(2,3)13-4-7-16-14(11-13)10-12-5-8-17-9-6-12;1-14(2,3)13-9-12(15-10-16-13)8-11-4-6-17-7-5-11;1-14(2,3)12-7-5-6-11(8-12)9-16(4)10-13(15)17;1-14(2,3)12-7-8-15-13(10-12)9-11-5-4-6-11/h6,8-9,16H,7,10-15,17H2,1-5H3;6-9,13,16H,10-12H2,1-5H3;6-12H,4-5H2,1-3H3;4-5,8-12H,6-7H2,1-3H3;4-6,9-12H,7-8H2,1-3H3;5-8,15H,9-11H2,1-4H3;4,7,11-12H,5-6,8-10H2,1-3H3;9-11H,4-8H2,1-3H3;5-8H,9-10H2,1-4H3,(H2,15,17);7-8,10-11H,4-6,9H2,1-3H3.
What are the key properties of 4-tert-butyl-2-(cyclobutylmethyl)pyridine;4-tert-butyl-2-(oxan-4-ylmethyl)pyridine;4-tert-butyl-6-(oxan-4-ylmethyl)pyrimidine;3-(4-tert-butylphenoxy)-1-propan-2-ylpyrrolidine;1-[3-(4-tert-butylphenoxy)pyrrolidin-1-yl]ethanone;2-[(3-tert-butylphenyl)methyl-methylamino]acetamide;4-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]-N,N-dimethylbutanamide;4-tert-butyl-2-(2-pyridin-2-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-3-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-4-ylethyl)pyridine?
4-tert-butyl-2-(cyclobutylmethyl)pyridine;4-tert-butyl-2-(oxan-4-ylmethyl)pyridine;4-tert-butyl-6-(oxan-4-ylmethyl)pyrimidine;3-(4-tert-butylphenoxy)-1-propan-2-ylpyrrolidine;1-[3-(4-tert-butylphenoxy)pyrrolidin-1-yl]ethanone;2-[(3-tert-butylphenyl)methyl-methylamino]acetamide;4-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]-N,N-dimethylbutanamide;4-tert-butyl-2-(2-pyridin-2-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-3-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-4-ylethyl)pyridine has a molecular weight of 2494.72 g/mol, XLogP of 32.19, 30 rotatable bonds, 1 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-2-(cyclobutylmethyl)pyridine;4-tert-butyl-2-(oxan-4-ylmethyl)pyridine;4-tert-butyl-6-(oxan-4-ylmethyl)pyrimidine;3-(4-tert-butylphenoxy)-1-propan-2-ylpyrrolidine;1-[3-(4-tert-butylphenoxy)pyrrolidin-1-yl]ethanone;2-[(3-tert-butylphenyl)methyl-methylamino]acetamide;4-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]-N,N-dimethylbutanamide;4-tert-butyl-2-(2-pyridin-2-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-3-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-4-ylethyl)pyridine is sourced from PubChem (CID 157211842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).