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

C168H197ClF3N15O9S2 — CID 160905229

IUPAC2-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
SMILESCC(C)c1ccc(Cc2ccccc2Cl)nc1.CC(C)c1ccnc(C(F)(F)F)c1.CC(C)c1ccnc(Cc2ccccc2)c1.CNC(=O)c1ccc(-c2cc(C(C)C)cnc2C)cc1.CNS(=O)(=O)c1ccc(-c2cc(C(C)C)cnc2C)cc1.COc1ccccc1Cc1cc(C(C)C)ccn1.COc1ccccc1Cc1ccc(C(C)C)cn1.Cc1ncc(C(C)C)cc1-c1ccc(CO)cc1.Cc1ncc(C(C)C)cc1-c1ccc(S(=O)(=O)N(C)C)cc1.Cc1ncc(C(C)C)cc1-c1cccc(C(N)=O)c1.Cc1ncc(C(C)C)cc1-c1ccccc1
InChIInChI=1S/C17H22N2O2S.C17H20N2O.C16H20N2O2S.C16H18N2O.3C16H19NO.C15H16ClN.2C15H17N.C9H10F3N/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)15-9-16(12(3)19-10-15)13-5-7-14(8-6-13)17(20)18-4;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)12-5-4-6-13(7-12)16(17)19;1-11(2)15-8-16(12(3)17-9-15)14-6-4-13(10-18)5-7-14;1-12(2)13-8-9-17-15(10-13)11-14-6-4-5-7-16(14)18-3;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;1-11(2)14-9-15(12(3)16-10-14)13-7-5-4-6-8-13;1-12(2)14-8-9-16-15(11-14)10-13-6-4-3-5-7-13;1-6(2)7-3-4-13-8(5-7)9(10,11)12/h6-12H,1-5H3;5-11H,1-4H3,(H,18,20);5-11,17H,1-4H3;4-10H,1-3H3,(H2,17,19);4-9,11,18H,10H2,1-3H3;4-10,12H,11H2,1-3H3;4-9,11-12H,10H2,1-3H3;3-8,10-11H,9H2,1-2H3;4-11H,1-3H3;3-9,11-12H,10H2,1-2H3;3-6H,1-2H3
InChIKeySQAYCQDYNJQISS-UHFFFAOYSA-N
MW2727.10 g/mol
LogP40.27
Rot. Bonds34

About 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

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 (PubChem CID 160905229) has the molecular formula C168H197ClF3N15O9S2 and a molecular weight of 2727.10 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name2-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
PubChem CID160905229
Molecular FormulaC168H197ClF3N15O9S2
Molecular Weight2727.10 g/mol
Exact Mass2724.45
IUPAC Name2-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
SMILESCC(C)c1ccc(Cc2ccccc2Cl)nc1.CC(C)c1ccnc(C(F)(F)F)c1.CC(C)c1ccnc(Cc2ccccc2)c1.CNC(=O)c1ccc(-c2cc(C(C)C)cnc2C)cc1.CNS(=O)(=O)c1ccc(-c2cc(C(C)C)cnc2C)cc1.COc1ccccc1Cc1cc(C(C)C)ccn1.COc1ccccc1Cc1ccc(C(C)C)cn1.Cc1ncc(C(C)C)cc1-c1ccc(CO)cc1.Cc1ncc(C(C)C)cc1-c1ccc(S(=O)(=O)N(C)C)cc1.Cc1ncc(C(C)C)cc1-c1cccc(C(N)=O)c1.Cc1ncc(C(C)C)cc1-c1ccccc1
InChIInChI=1S/C17H22N2O2S.C17H20N2O.C16H20N2O2S.C16H18N2O.3C16H19NO.C15H16ClN.2C15H17N.C9H10F3N/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)15-9-16(12(3)19-10-15)13-5-7-14(8-6-13)17(20)18-4;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)12-5-4-6-13(7-12)16(17)19;1-11(2)15-8-16(12(3)17-9-15)14-6-4-13(10-18)5-7-14;1-12(2)13-8-9-17-15(10-13)11-14-6-4-5-7-16(14)18-3;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;1-11(2)14-9-15(12(3)16-10-14)13-7-5-4-6-8-13;1-12(2)14-8-9-16-15(11-14)10-13-6-4-3-5-7-13;1-6(2)7-3-4-13-8(5-7)9(10,11)12/h6-12H,1-5H3;5-11H,1-4H3,(H,18,20);5-11,17H,1-4H3;4-10H,1-3H3,(H2,17,19);4-9,11,18H,10H2,1-3H3;4-10,12H,11H2,1-3H3;4-9,11-12H,10H2,1-3H3;3-8,10-11H,9H2,1-2H3;4-11H,1-3H3;3-9,11-12H,10H2,1-2H3;3-6H,1-2H3
InChIKeySQAYCQDYNJQISS-UHFFFAOYSA-N
XLogP40.27
TPSA336.22 Ų
H-Bond Donors4
H-Bond Acceptors20
Rotatable Bonds34
Heavy Atoms198
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002727.10
LogP ≤ 540.27
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1020

Analyze 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 with MolForge

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Launch Full Analysis

Related Compounds

2-benzyl-4-propan-2-ylpyridine;2-[(2-methoxyphenyl)methyl]-4-propan-2-ylpyridine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;3-(3-methyl-4-propan-2-yl-2-pyridinyl)benzoic acid;1-[3-(2-methyl-5-propan-2-yl-3-pyridinyl)phenyl]ethenamine;[4-(2-methyl-5-propan-2-yl-3-pyridinyl)phenyl]methanol;4-propan-2-yl-2-(trifluoromethyl)pyridine
CID 159834075
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;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzamide;2-methyl-3-phenyl-5-propan-2-ylpyridine;3-(3-methyl-4-propan-2-yl-2-pyridinyl)benzoic acid;1-[3-(2-methyl-5-propan-2-yl-3-pyridinyl)phenyl]ethenamine;[4-(2-methyl-5-propan-2-yl-3-pyridinyl)phenyl]methanol;4-propan-2-yl-6-(trifluoromethyl)pyrimidine
CID 161467275
4-chloro-3-[(4-methylphenyl)sulfonylmethyl]-N-(pyridin-3-ylmethyl)benzamide;4-ethyl-3-[(4-methylphenyl)sulfonylmethyl]-N-(pyridin-3-ylmethyl)benzamide;3-fluoro-5-[(4-methylphenyl)sulfonylmethyl]-N-(pyridin-3-ylmethyl)benzamide;4-fluoro-3-[(4-methylphenyl)sulfonylmethyl]-N-(pyridin-3-ylmethyl)benzamide;3-methoxy-5-[(4-methylphenyl)sulfonylmethyl]-N-(pyridin-3-ylmethyl)benzamide;4-methoxy-3-[(4-methylphenyl)sulfonylmethyl]-N-(pyridin-3-ylmethyl)benzamide;3-methyl-5-[(4-methylphenyl)sulfonylmethyl]-N-(pyridin-3-ylmethyl)benzamide;4-methyl-3-[(4-methylphenyl)sulfonylmethyl]-N-(pyridin-3-ylmethyl)benzamide;3-[(4-methylphenyl)sulfonylmethyl]-N-(pyridin-3-ylmethyl)benzamide
CID 157132856
1-tert-butyl-3-chloro-5-propan-2-ylbenzene;3-chloro-2-methoxy-5-propan-2-ylpyridine;1-chloro-2-propan-2-ylbenzene;cumene;1,2-difluoro-4-propan-2-ylbenzene;N,N-dimethyl-3-propan-2-ylbenzamide;2,4-di(propan-2-yl)pyridine;3-fluoro-2-methoxy-5-propan-2-ylpyridine;1-fluoro-2-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;(3-methoxy-5-propan-2-ylphenyl)methanol;2-methoxy-5-propan-2-ylpyridine;1-methyl-2-propan-2-ylbenzene;1-methylsulfonyl-3-propan-2-ylbenzene;3-propan-2-ylbenzamide;1-(3-propan-2-ylphenyl)ethanone;(3-propan-2-ylphenyl)methanamine;3-propan-2-ylpyridine
CID 157147286
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-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
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
1-[(1S)-1-[3-(3-acetyl-4-fluorophenyl)-2-pyridinyl]-2-(3,5-difluorophenyl)ethyl]-3-(2-chlorophenyl)sulfonylurea;1-[(1S)-1-[3-(3-acetyl-4-fluorophenyl)-2-pyridinyl]-2-(3,5-difluorophenyl)ethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-2-(3,5-difluorophenyl)-1-[3-(4-ethoxyphenyl)-2-pyridinyl]ethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-2-(3,5-difluorophenyl)-1-[3-(4-methoxyphenyl)-2-pyridinyl]ethyl]-3-(2-methylphenyl)sulfonylurea;1-[1-[3-(4-ethoxyphenyl)-2-pyridinyl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea
CID 160469198
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
CID 161839396
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]-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 162110064

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is CC(C)c1ccc(Cc2ccccc2Cl)nc1.CC(C)c1ccnc(C(F)(F)F)c1.CC(C)c1ccnc(Cc2ccccc2)c1.CNC(=O)c1ccc(-c2cc(C(C)C)cnc2C)cc1.CNS(=O)(=O)c1ccc(-c2cc(C(C)C)cnc2C)cc1.COc1ccccc1Cc1cc(C(C)C)ccn1.COc1ccccc1Cc1ccc(C(C)C)cn1.Cc1ncc(C(C)C)cc1-c1ccc(CO)cc1.Cc1ncc(C(C)C)cc1-c1ccc(S(=O)(=O)N(C)C)cc1.Cc1ncc(C(C)C)cc1-c1cccc(C(N)=O)c1.Cc1ncc(C(C)C)cc1-c1ccccc1.
What is the InChIKey of 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?
The InChIKey is SQAYCQDYNJQISS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2S.C17H20N2O.C16H20N2O2S.C16H18N2O.3C16H19NO.C15H16ClN.2C15H17N.C9H10F3N/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)15-9-16(12(3)19-10-15)13-5-7-14(8-6-13)17(20)18-4;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)12-5-4-6-13(7-12)16(17)19;1-11(2)15-8-16(12(3)17-9-15)14-6-4-13(10-18)5-7-14;1-12(2)13-8-9-17-15(10-13)11-14-6-4-5-7-16(14)18-3;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;1-11(2)14-9-15(12(3)16-10-14)13-7-5-4-6-8-13;1-12(2)14-8-9-16-15(11-14)10-13-6-4-3-5-7-13;1-6(2)7-3-4-13-8(5-7)9(10,11)12/h6-12H,1-5H3;5-11H,1-4H3,(H,18,20);5-11,17H,1-4H3;4-10H,1-3H3,(H2,17,19);4-9,11,18H,10H2,1-3H3;4-10,12H,11H2,1-3H3;4-9,11-12H,10H2,1-3H3;3-8,10-11H,9H2,1-2H3;4-11H,1-3H3;3-9,11-12H,10H2,1-2H3;3-6H,1-2H3.
What are the key properties of 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?
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 has a molecular weight of 2727.10 g/mol, XLogP of 40.27, 34 rotatable bonds, 4 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 160905229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).