2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyridine;2-(2-chlorophenyl)-5-propan-2-ylpyridine;N,N-dimethyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyridine;N-(2-methoxyphenyl)-5-propan-2-ylpyridin-2-amine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-methyl-3-phenyl-5-propan-2-ylpyridine;4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide

C139H162Cl2N14O9S3 — CID 158085587

IUPAC2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyridine;2-(2-chlorophenyl)-5-propan-2-ylpyridine;N,N-dimethyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyridine;N-(2-methoxyphenyl)-5-propan-2-ylpyridin-2-amine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-methyl-3-phenyl-5-propan-2-ylpyridine;4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide
SMILESCC(C)c1ccc(-c2ccccc2Cl)nc1.CC(C)c1ccc(Cc2ccccc2Cl)nc1.CNS(=O)(=O)c1ccc(-c2cc(C(C)C)cnc2C)cc1.COc1ccccc1Cc1ccc(C(C)C)cn1.COc1ccccc1Nc1ccc(C(C)C)cn1.Cc1ncc(C(C)C)cc1-c1ccc(C(N)=O)cc1.Cc1ncc(C(C)C)cc1-c1ccc(S(=O)(=O)N(C)C)cc1.Cc1ncc(C(C)C)cc1-c1cccc(S(N)(=O)=O)c1.Cc1ncc(C(C)C)cc1-c1ccccc1
InChIInChI=1S/C17H22N2O2S.C16H20N2O2S.C16H18N2O.C16H19NO.C15H16ClN.C15H18N2O2S.C15H18N2O.C15H17N.C14H14ClN/c1-12(2)15-10-17(13(3)18-11-15)14-6-8-16(9-7-14)22(20,21)19(4)5;1-11(2)14-9-16(12(3)18-10-14)13-5-7-15(8-6-13)21(19,20)17-4;1-10(2)14-8-15(11(3)18-9-14)12-4-6-13(7-5-12)16(17)19;1-12(2)14-8-9-15(17-11-14)10-13-6-4-5-7-16(13)18-3;1-11(2)13-7-8-14(17-10-13)9-12-5-3-4-6-15(12)16;1-10(2)13-8-15(11(3)17-9-13)12-5-4-6-14(7-12)20(16,18)19;1-11(2)12-8-9-15(16-10-12)17-13-6-4-5-7-14(13)18-3;1-11(2)14-9-15(12(3)16-10-14)13-7-5-4-6-8-13;1-10(2)11-7-8-14(16-9-11)12-5-3-4-6-13(12)15/h6-12H,1-5H3;5-11,17H,1-4H3;4-10H,1-3H3,(H2,17,19);4-9,11-12H,10H2,1-3H3;3-8,10-11H,9H2,1-2H3;4-10H,1-3H3,(H2,16,18,19);4-11H,1-3H3,(H,16,17);4-11H,1-3H3;3-10H,1-2H3
InChIKeyFNLYKHCBAZPUJT-UHFFFAOYSA-N
MW2340.02 g/mol
LogP33.54
Rot. Bonds29

About 2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyridine;2-(2-chlorophenyl)-5-propan-2-ylpyridine;N,N-dimethyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyridine;N-(2-methoxyphenyl)-5-propan-2-ylpyridin-2-amine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-methyl-3-phenyl-5-propan-2-ylpyridine;4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide

2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyridine;2-(2-chlorophenyl)-5-propan-2-ylpyridine;N,N-dimethyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyridine;N-(2-methoxyphenyl)-5-propan-2-ylpyridin-2-amine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-methyl-3-phenyl-5-propan-2-ylpyridine;4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide (PubChem CID 158085587) has the molecular formula C139H162Cl2N14O9S3 and a molecular weight of 2340.02 g/mol. Its IUPAC name is 2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyridine;2-(2-chlorophenyl)-5-propan-2-ylpyridine;N,N-dimethyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyridine;N-(2-methoxyphenyl)-5-propan-2-ylpyridin-2-amine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-methyl-3-phenyl-5-propan-2-ylpyridine;4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide.

Molecular Properties

Compound Name2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyridine;2-(2-chlorophenyl)-5-propan-2-ylpyridine;N,N-dimethyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyridine;N-(2-methoxyphenyl)-5-propan-2-ylpyridin-2-amine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-methyl-3-phenyl-5-propan-2-ylpyridine;4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide
PubChem CID158085587
Molecular FormulaC139H162Cl2N14O9S3
Molecular Weight2340.02 g/mol
Exact Mass2337.12
IUPAC Name2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyridine;2-(2-chlorophenyl)-5-propan-2-ylpyridine;N,N-dimethyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyridine;N-(2-methoxyphenyl)-5-propan-2-ylpyridin-2-amine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-methyl-3-phenyl-5-propan-2-ylpyridine;4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide
SMILESCC(C)c1ccc(-c2ccccc2Cl)nc1.CC(C)c1ccc(Cc2ccccc2Cl)nc1.CNS(=O)(=O)c1ccc(-c2cc(C(C)C)cnc2C)cc1.COc1ccccc1Cc1ccc(C(C)C)cn1.COc1ccccc1Nc1ccc(C(C)C)cn1.Cc1ncc(C(C)C)cc1-c1ccc(C(N)=O)cc1.Cc1ncc(C(C)C)cc1-c1ccc(S(=O)(=O)N(C)C)cc1.Cc1ncc(C(C)C)cc1-c1cccc(S(N)(=O)=O)c1.Cc1ncc(C(C)C)cc1-c1ccccc1
InChIInChI=1S/C17H22N2O2S.C16H20N2O2S.C16H18N2O.C16H19NO.C15H16ClN.C15H18N2O2S.C15H18N2O.C15H17N.C14H14ClN/c1-12(2)15-10-17(13(3)18-11-15)14-6-8-16(9-7-14)22(20,21)19(4)5;1-11(2)14-9-16(12(3)18-10-14)13-5-7-15(8-6-13)21(19,20)17-4;1-10(2)14-8-15(11(3)18-9-14)12-4-6-13(7-5-12)16(17)19;1-12(2)14-8-9-15(17-11-14)10-13-6-4-5-7-16(13)18-3;1-11(2)13-7-8-14(17-10-13)9-12-5-3-4-6-15(12)16;1-10(2)13-8-15(11(3)17-9-13)12-5-4-6-14(7-12)20(16,18)19;1-11(2)12-8-9-15(16-10-12)17-13-6-4-5-7-14(13)18-3;1-11(2)14-9-15(12(3)16-10-14)13-7-5-4-6-8-13;1-10(2)11-7-8-14(16-9-11)12-5-3-4-6-13(12)15/h6-12H,1-5H3;5-11,17H,1-4H3;4-10H,1-3H3,(H2,17,19);4-9,11-12H,10H2,1-3H3;3-8,10-11H,9H2,1-2H3;4-10H,1-3H3,(H2,16,18,19);4-11H,1-3H3,(H,16,17);4-11H,1-3H3;3-10H,1-2H3
InChIKeyFNLYKHCBAZPUJT-UHFFFAOYSA-N
XLogP33.54
TPSA333.30 Ų
H-Bond Donors4
H-Bond Acceptors19
Rotatable Bonds29
Heavy Atoms167
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002340.02
LogP ≤ 533.54
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1019

Analyze 2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyridine;2-(2-chlorophenyl)-5-propan-2-ylpyridine;N,N-dimethyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyridine;N-(2-methoxyphenyl)-5-propan-2-ylpyridin-2-amine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-methyl-3-phenyl-5-propan-2-ylpyridine;4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide with MolForge

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Launch Full Analysis

Related Compounds

2-benzyl-4-propan-2-ylpyridine;2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyridine;N,N-dimethyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-[(2-methoxyphenyl)methyl]-4-propan-2-ylpyridine;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyridine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-methyl-3-phenyl-5-propan-2-ylpyridine;3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;[4-(2-methyl-5-propan-2-yl-3-pyridinyl)phenyl]methanol;4-propan-2-yl-2-(trifluoromethyl)pyridine
CID 160905229
2-benzyl-4-propan-2-ylpyridine;2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyridine;N,N-dimethyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-[(2-methoxyphenyl)methyl]-4-propan-2-ylpyridine;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyridine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-methyl-3-phenyl-5-propan-2-ylpyridine;1-[3-(2-methyl-5-propan-2-yl-3-pyridinyl)phenyl]ethenamine;[4-(2-methyl-5-propan-2-yl-3-pyridinyl)phenyl]methanol
CID 157781835
2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyrazine;2-[(2-chlorophenyl)methyl]-6-propan-2-ylpyrazine;2-isocyano-5-propan-2-ylpyridine;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyrazine;2-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyrazine;N-(2-methoxyphenyl)-5-propan-2-ylpyrazin-2-amine;2-(2-methoxyphenyl)-5-propan-2-ylpyridine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-phenyl-5-propan-2-ylpyridine
CID 158316147
3-[3-(benzenesulfonyl)-2-oxopropyl]-6-(2-chloro-6-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-3-[(6-methyl-3-pyridinyl)methylsulfinylmethyl]-7-phenyl-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-3-[(6-methyl-3-pyridinyl)methylsulfonylmethyl]-7-phenyl-1H-1,8-naphthyridin-4-one;2-[6-(2-chloro-6-methyl-4-pyridinyl)-4-oxo-7-phenyl-1H-1,8-naphthyridin-2-yl]-N-ethylsulfonylacetamide;1-[6-(2-chloro-6-methyl-4-pyridinyl)-4-oxo-7-phenyl-1H-1,8-naphthyridin-2-yl]-N-(4-methoxyphenyl)methanesulfinamide;1-[6-(2-chloro-6-methyl-4-pyridinyl)-4-oxo-7-phenyl-1H-1,8-naphthyridin-2-yl]-N-(4-methoxyphenyl)methanesulfonamide;N-[[6-(2-chloro-6-methyl-4-pyridinyl)-4-oxo-7-phenyl-1H-1,8-naphthyridin-3-yl]methyl]-6-methylpyridine-3-sulfonamide
CID 158407226
2-benzyl-5-propan-2-ylpyridine;2-(2-chlorophenyl)-5-propan-2-ylpyridine;N,N-dimethyl-3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-(2,3-dimethylphenoxy)-5-propan-2-ylpyridine;2,5-di(propan-2-yl)pyridine;3-(3-ethylphenyl)-2-methyl-5-propan-2-ylpyridine;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyridine;N-(2-methoxyphenyl)-5-propan-2-ylpyridin-2-amine;2-(4-methylphenyl)sulfonyl-3-propan-2-ylpyridine;4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;1-[3-(2-methyl-5-propan-2-yl-3-pyridinyl)phenyl]ethenol
CID 158591832
2-benzyl-5-propan-2-ylpyridine;2-[(2-chlorophenyl)methyl]-6-propan-2-ylpyrazine;2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyrimidine;2-(2,3-dimethylphenoxy)-5-propan-2-ylpyridine;2-isocyano-5-propan-2-ylpyridine;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyrimidine;N-(2-methoxyphenyl)-5-propan-2-ylpyrazin-2-amine;2-(2-methoxyphenyl)-5-propan-2-ylpyridine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzoic acid;2-phenyl-5-propan-2-ylpyridine
CID 159161265
2-(2-chlorophenyl)-5-propan-2-ylpyridine;N,N-dimethyl-3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2,5-di(propan-2-yl)pyridine;N-(2-methoxyphenyl)-5-propan-2-ylpyridin-2-amine;2-(4-methylphenyl)sulfonyl-3-propan-2-ylpyridine;4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;[3-(2-methyl-5-propan-2-yl-3-pyridinyl)phenyl]methanol
CID 159257248
2-benzyl-5-propan-2-ylpyridine;2-(2-chlorophenyl)-5-propan-2-ylpyridine;N,N-dimethyl-3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-(2,3-dimethylphenoxy)-5-propan-2-ylpyridine;2,5-di(propan-2-yl)pyridine;N-(2-methoxyphenyl)-5-propan-2-ylpyridin-2-amine;2-(4-methylphenyl)sulfonyl-3-propan-2-ylpyridine;4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzoic acid;[3-(2-methyl-5-propan-2-yl-3-pyridinyl)phenyl]methanol;2-phenyl-5-propan-2-ylpyridine
CID 159560486
2-(2-chlorophenyl)-5-propan-2-ylpyridine;N,N-dimethyl-3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2,5-di(propan-2-yl)pyridine;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyridine;N-(2-methoxyphenyl)-5-propan-2-ylpyridin-2-amine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-(4-methylphenyl)sulfonyl-3-propan-2-ylpyridine;4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;[3-(2-methyl-5-propan-2-yl-3-pyridinyl)phenyl]methanol
CID 159782929
2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyridine;2-(2-chlorophenyl)-5-propan-2-ylpyridine;2,5-di(propan-2-yl)pyridine;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyridine;N-(2-methoxyphenyl)-5-propan-2-ylpyridin-2-amine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-methyl-3-phenyl-5-propan-2-ylpyridine;4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;[3-(2-methyl-5-propan-2-yl-3-pyridinyl)phenyl]methanol
CID 160360130
2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyrazine;2-[(2-chlorophenyl)methyl]-6-propan-2-ylpyrazine;2-isocyano-5-propan-2-ylpyridine;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyrazine;2-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyrazine;N-(2-methoxyphenyl)-5-propan-2-ylpyrazin-2-amine;2-(2-methoxyphenyl)-5-propan-2-ylpyridine;N-methyl-4-(5-methyl-2-propan-2-yl-4-pyridinyl)benzenesulfonamide;2-phenyl-5-propan-2-ylpyridine
CID 160587499
2-benzyl-5-propan-2-ylpyridine;2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyrazine;2-[(2-chlorophenyl)methyl]-6-propan-2-ylpyrazine;2-(2,3-dimethylphenoxy)-5-propan-2-ylpyridine;2-isocyano-5-propan-2-ylpyridine;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyrazine;N-(2-methoxyphenyl)-5-propan-2-ylpyrazin-2-amine;2-(2-methoxyphenyl)-5-propan-2-ylpyridine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzoic acid;2-phenyl-5-propan-2-ylpyridine
CID 161269725

Frequently Asked Questions

What is the IUPAC name of 2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyridine;2-(2-chlorophenyl)-5-propan-2-ylpyridine;N,N-dimethyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyridine;N-(2-methoxyphenyl)-5-propan-2-ylpyridin-2-amine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-methyl-3-phenyl-5-propan-2-ylpyridine;4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide?
The IUPAC name of 2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyridine;2-(2-chlorophenyl)-5-propan-2-ylpyridine;N,N-dimethyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyridine;N-(2-methoxyphenyl)-5-propan-2-ylpyridin-2-amine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-methyl-3-phenyl-5-propan-2-ylpyridine;4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide (CID 158085587) is 2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyridine;2-(2-chlorophenyl)-5-propan-2-ylpyridine;N,N-dimethyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyridine;N-(2-methoxyphenyl)-5-propan-2-ylpyridin-2-amine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-methyl-3-phenyl-5-propan-2-ylpyridine;4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide.
What is the SMILES notation for 2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyridine;2-(2-chlorophenyl)-5-propan-2-ylpyridine;N,N-dimethyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyridine;N-(2-methoxyphenyl)-5-propan-2-ylpyridin-2-amine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-methyl-3-phenyl-5-propan-2-ylpyridine;4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide?
The canonical SMILES for 2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyridine;2-(2-chlorophenyl)-5-propan-2-ylpyridine;N,N-dimethyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyridine;N-(2-methoxyphenyl)-5-propan-2-ylpyridin-2-amine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-methyl-3-phenyl-5-propan-2-ylpyridine;4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide is CC(C)c1ccc(-c2ccccc2Cl)nc1.CC(C)c1ccc(Cc2ccccc2Cl)nc1.CNS(=O)(=O)c1ccc(-c2cc(C(C)C)cnc2C)cc1.COc1ccccc1Cc1ccc(C(C)C)cn1.COc1ccccc1Nc1ccc(C(C)C)cn1.Cc1ncc(C(C)C)cc1-c1ccc(C(N)=O)cc1.Cc1ncc(C(C)C)cc1-c1ccc(S(=O)(=O)N(C)C)cc1.Cc1ncc(C(C)C)cc1-c1cccc(S(N)(=O)=O)c1.Cc1ncc(C(C)C)cc1-c1ccccc1.
What is the InChIKey of 2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyridine;2-(2-chlorophenyl)-5-propan-2-ylpyridine;N,N-dimethyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyridine;N-(2-methoxyphenyl)-5-propan-2-ylpyridin-2-amine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-methyl-3-phenyl-5-propan-2-ylpyridine;4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide?
The InChIKey is FNLYKHCBAZPUJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2S.C16H20N2O2S.C16H18N2O.C16H19NO.C15H16ClN.C15H18N2O2S.C15H18N2O.C15H17N.C14H14ClN/c1-12(2)15-10-17(13(3)18-11-15)14-6-8-16(9-7-14)22(20,21)19(4)5;1-11(2)14-9-16(12(3)18-10-14)13-5-7-15(8-6-13)21(19,20)17-4;1-10(2)14-8-15(11(3)18-9-14)12-4-6-13(7-5-12)16(17)19;1-12(2)14-8-9-15(17-11-14)10-13-6-4-5-7-16(13)18-3;1-11(2)13-7-8-14(17-10-13)9-12-5-3-4-6-15(12)16;1-10(2)13-8-15(11(3)17-9-13)12-5-4-6-14(7-12)20(16,18)19;1-11(2)12-8-9-15(16-10-12)17-13-6-4-5-7-14(13)18-3;1-11(2)14-9-15(12(3)16-10-14)13-7-5-4-6-8-13;1-10(2)11-7-8-14(16-9-11)12-5-3-4-6-13(12)15/h6-12H,1-5H3;5-11,17H,1-4H3;4-10H,1-3H3,(H2,17,19);4-9,11-12H,10H2,1-3H3;3-8,10-11H,9H2,1-2H3;4-10H,1-3H3,(H2,16,18,19);4-11H,1-3H3,(H,16,17);4-11H,1-3H3;3-10H,1-2H3.
What are the key properties of 2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyridine;2-(2-chlorophenyl)-5-propan-2-ylpyridine;N,N-dimethyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyridine;N-(2-methoxyphenyl)-5-propan-2-ylpyridin-2-amine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-methyl-3-phenyl-5-propan-2-ylpyridine;4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide?
2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyridine;2-(2-chlorophenyl)-5-propan-2-ylpyridine;N,N-dimethyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyridine;N-(2-methoxyphenyl)-5-propan-2-ylpyridin-2-amine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-methyl-3-phenyl-5-propan-2-ylpyridine;4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide has a molecular weight of 2340.02 g/mol, XLogP of 33.54, 29 rotatable bonds, 4 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyridine;2-(2-chlorophenyl)-5-propan-2-ylpyridine;N,N-dimethyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyridine;N-(2-methoxyphenyl)-5-propan-2-ylpyridin-2-amine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-methyl-3-phenyl-5-propan-2-ylpyridine;4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;3-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide is sourced from PubChem (CID 158085587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).