2-benzyl-5-propan-2-ylpyridine;2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyrazine;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;2-isocyano-5-propan-2-ylpyridine;2-(2-methoxyphenyl)-5-propan-2-ylpyridine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-(4-methylphenyl)sulfonyl-3-propan-2-ylpyridine;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

C174H205ClN16O11S3 — CID 160790495

About 2-benzyl-5-propan-2-ylpyridine;2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyrazine;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;2-isocyano-5-propan-2-ylpyridine;2-(2-methoxyphenyl)-5-propan-2-ylpyridine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-(4-methylphenyl)sulfonyl-3-propan-2-ylpyridine;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

2-benzyl-5-propan-2-ylpyridine;2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyrazine;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;2-isocyano-5-propan-2-ylpyridine;2-(2-methoxyphenyl)-5-propan-2-ylpyridine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-(4-methylphenyl)sulfonyl-3-propan-2-ylpyridine;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 (PubChem CID 160790495) has the molecular formula C174H205ClN16O11S3 and a molecular weight of 2828.31 g/mol. Its IUPAC name is 2-benzyl-5-propan-2-ylpyridine;2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyrazine;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;2-isocyano-5-propan-2-ylpyridine;2-(2-methoxyphenyl)-5-propan-2-ylpyridine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-(4-methylphenyl)sulfonyl-3-propan-2-ylpyridine;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.

Molecular Properties

• Compound Name: 2-benzyl-5-propan-2-ylpyridine;2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyrazine;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;2-isocyano-5-propan-2-ylpyridine;2-(2-methoxyphenyl)-5-propan-2-ylpyridine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-(4-methylphenyl)sulfonyl-3-propan-2-ylpyridine;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
• PubChem CID: 160790495
• Molecular Formula: C174H205ClN16O11S3
• Molecular Weight: 2828.31 g/mol
• Exact Mass: 2825.48
• IUPAC Name: 2-benzyl-5-propan-2-ylpyridine;2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyrazine;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;2-isocyano-5-propan-2-ylpyridine;2-(2-methoxyphenyl)-5-propan-2-ylpyridine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-(4-methylphenyl)sulfonyl-3-propan-2-ylpyridine;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
• SMILES: CC(C)c1ccc(-c2ccccc2)nc1.CC(C)c1ccc(C(C)C)nc1.CC(C)c1ccc(Cc2ccccc2)nc1.CC(C)c1cnc(Cc2ccccc2Cl)cn1.CNS(=O)(=O)c1ccc(-c2cc(C(C)C)cnc2C)cc1.COc1ccccc1-c1ccc(C(C)C)cn1.Cc1ccc(S(=O)(=O)c2ncccc2C(C)C)cc1.Cc1cccc(Oc2ccc(C(C)C)cn2)c1C.Cc1ncc(C(C)C)cc1-c1cccc(C(=O)O)c1.Cc1ncc(C(C)C)cc1-c1cccc(CO)c1.Cc1ncc(C(C)C)cc1-c1cccc(S(=O)(=O)N(C)C)c1.[C-]#[N+]c1ccc(C(C)C)cn1
• InChI: InChI=1S/C17H22N2O2S.C16H20N2O2S.C16H17NO2.2C16H19NO.C15H17NO2S.C15H17NO.C15H17N.C14H15ClN2.C14H15N.C11H17N.C9H10N2/c1-12(2)15-10-17(13(3)18-11-15)14-7-6-8-16(9-14)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)17-9-14)12-5-4-6-13(7-12)16(18)19;1-11(2)14-8-9-16(17-10-14)18-15-7-5-6-12(3)13(15)4;1-11(2)15-8-16(12(3)17-9-15)14-6-4-5-13(7-14)10-18;1-11(2)14-5-4-10-16-15(14)19(17,18)13-8-6-12(3)7-9-13;1-11(2)12-8-9-14(16-10-12)13-6-4-5-7-15(13)17-3;1-12(2)14-8-9-15(16-11-14)10-13-6-4-3-5-7-13;1-10(2)14-9-16-12(8-17-14)7-11-5-3-4-6-13(11)15;1-11(2)13-8-9-14(15-10-13)12-6-4-3-5-7-12;1-8(2)10-5-6-11(9(3)4)12-7-10;1-7(2)8-4-5-9(10-3)11-6-8/h6-12H,1-5H3;5-11,17H,1-4H3;4-10H,1-3H3,(H,18,19);5-11H,1-4H3;4-9,11,18H,10H2,1-3H3;4-11H,1-3H3;4-11H,1-3H3;3-9,11-12H,10H2,1-2H3;3-6,8-10H,7H2,1-2H3;3-11H,1-2H3;5-9H,1-4H3;4-7H,1-2H3
• InChIKey: SBTPKKGDEZLPTF-UHFFFAOYSA-N
• XLogP: 43.51
• TPSA: 365.61 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 23
• Rotatable Bonds: 34
• Heavy Atoms: 205
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2828.31
LogP ≤ 5	43.51
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-5-propan-2-ylpyridine;2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyrazine;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;2-isocyano-5-propan-2-ylpyridine;2-(2-methoxyphenyl)-5-propan-2-ylpyridine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-(4-methylphenyl)sulfonyl-3-propan-2-ylpyridine;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?

The IUPAC name of 2-benzyl-5-propan-2-ylpyridine;2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyrazine;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;2-isocyano-5-propan-2-ylpyridine;2-(2-methoxyphenyl)-5-propan-2-ylpyridine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-(4-methylphenyl)sulfonyl-3-propan-2-ylpyridine;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 160790495) is 2-benzyl-5-propan-2-ylpyridine;2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyrazine;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;2-isocyano-5-propan-2-ylpyridine;2-(2-methoxyphenyl)-5-propan-2-ylpyridine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-(4-methylphenyl)sulfonyl-3-propan-2-ylpyridine;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.

What is the SMILES notation for 2-benzyl-5-propan-2-ylpyridine;2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyrazine;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;2-isocyano-5-propan-2-ylpyridine;2-(2-methoxyphenyl)-5-propan-2-ylpyridine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-(4-methylphenyl)sulfonyl-3-propan-2-ylpyridine;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?

The canonical SMILES for 2-benzyl-5-propan-2-ylpyridine;2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyrazine;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;2-isocyano-5-propan-2-ylpyridine;2-(2-methoxyphenyl)-5-propan-2-ylpyridine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-(4-methylphenyl)sulfonyl-3-propan-2-ylpyridine;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 is CC(C)c1ccc(-c2ccccc2)nc1.CC(C)c1ccc(C(C)C)nc1.CC(C)c1ccc(Cc2ccccc2)nc1.CC(C)c1cnc(Cc2ccccc2Cl)cn1.CNS(=O)(=O)c1ccc(-c2cc(C(C)C)cnc2C)cc1.COc1ccccc1-c1ccc(C(C)C)cn1.Cc1ccc(S(=O)(=O)c2ncccc2C(C)C)cc1.Cc1cccc(Oc2ccc(C(C)C)cn2)c1C.Cc1ncc(C(C)C)cc1-c1cccc(C(=O)O)c1.Cc1ncc(C(C)C)cc1-c1cccc(CO)c1.Cc1ncc(C(C)C)cc1-c1cccc(S(=O)(=O)N(C)C)c1.[C-]#[N+]c1ccc(C(C)C)cn1.

What is the InChIKey of 2-benzyl-5-propan-2-ylpyridine;2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyrazine;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;2-isocyano-5-propan-2-ylpyridine;2-(2-methoxyphenyl)-5-propan-2-ylpyridine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-(4-methylphenyl)sulfonyl-3-propan-2-ylpyridine;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?

The InChIKey is SBTPKKGDEZLPTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2S.C16H20N2O2S.C16H17NO2.2C16H19NO.C15H17NO2S.C15H17NO.C15H17N.C14H15ClN2.C14H15N.C11H17N.C9H10N2/c1-12(2)15-10-17(13(3)18-11-15)14-7-6-8-16(9-14)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)17-9-14)12-5-4-6-13(7-12)16(18)19;1-11(2)14-8-9-16(17-10-14)18-15-7-5-6-12(3)13(15)4;1-11(2)15-8-16(12(3)17-9-15)14-6-4-5-13(7-14)10-18;1-11(2)14-5-4-10-16-15(14)19(17,18)13-8-6-12(3)7-9-13;1-11(2)12-8-9-14(16-10-12)13-6-4-5-7-15(13)17-3;1-12(2)14-8-9-15(16-11-14)10-13-6-4-3-5-7-13;1-10(2)14-9-16-12(8-17-14)7-11-5-3-4-6-13(11)15;1-11(2)13-8-9-14(15-10-13)12-6-4-3-5-7-12;1-8(2)10-5-6-11(9(3)4)12-7-10;1-7(2)8-4-5-9(10-3)11-6-8/h6-12H,1-5H3;5-11,17H,1-4H3;4-10H,1-3H3,(H,18,19);5-11H,1-4H3;4-9,11,18H,10H2,1-3H3;4-11H,1-3H3;4-11H,1-3H3;3-9,11-12H,10H2,1-2H3;3-6,8-10H,7H2,1-2H3;3-11H,1-2H3;5-9H,1-4H3;4-7H,1-2H3.

What are the key properties of 2-benzyl-5-propan-2-ylpyridine;2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyrazine;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;2-isocyano-5-propan-2-ylpyridine;2-(2-methoxyphenyl)-5-propan-2-ylpyridine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-(4-methylphenyl)sulfonyl-3-propan-2-ylpyridine;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?

2-benzyl-5-propan-2-ylpyridine;2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyrazine;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;2-isocyano-5-propan-2-ylpyridine;2-(2-methoxyphenyl)-5-propan-2-ylpyridine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-(4-methylphenyl)sulfonyl-3-propan-2-ylpyridine;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 has a molecular weight of 2828.31 g/mol, XLogP of 43.51, 34 rotatable bonds, 3 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 2-benzyl-5-propan-2-ylpyridine;2-[(2-chlorophenyl)methyl]-5-propan-2-ylpyrazine;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;2-isocyano-5-propan-2-ylpyridine;2-(2-methoxyphenyl)-5-propan-2-ylpyridine;N-methyl-4-(2-methyl-5-propan-2-yl-3-pyridinyl)benzenesulfonamide;2-(4-methylphenyl)sulfonyl-3-propan-2-ylpyridine;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 is sourced from PubChem (CID 160790495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).