5-bromo-2-methylpyridine;5-bromo-2-methylpyrimidine;bis(2-chloro-4-fluoro-5-methylpyridine);4-chloro-5-fluoro-2-methylpyridine;5-chloro-4-fluoro-2-methylpyridine;5-chloro-3-isocyano-2-methylpyridine;5-chloro-2-methyl-3-methylperoxysulfanylpyridine;5-chloro-2-methylpyridin-4-amine;bis(2-chloro-5-methylpyridine);5-chloro-2-methylpyridine;5-chloro-2-methylpyridine-3-carboxamide;O-[(5-chloro-2-methyl-3-pyridinyl)sulfanyloxy]hydroxylamine;5-chloro-2-methylpyrimidine;3-fluoro-2-methylpyridine;5-fluoro-2-methylpyrimidine;5-methoxy-2-methylpyridine;5-methylpyridazin-3-amine;4-methylpyridazine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;5-methylpyridin-2-amine;6-methylpyridin-3-amine;6-methylpyridin-3-ol;6-methylpyrimidin-4-amine

C154H167Br2Cl13F6N42O7S2 — CID 162183764

About 5-bromo-2-methylpyridine;5-bromo-2-methylpyrimidine;bis(2-chloro-4-fluoro-5-methylpyridine);4-chloro-5-fluoro-2-methylpyridine;5-chloro-4-fluoro-2-methylpyridine;5-chloro-3-isocyano-2-methylpyridine;5-chloro-2-methyl-3-methylperoxysulfanylpyridine;5-chloro-2-methylpyridin-4-amine;bis(2-chloro-5-methylpyridine);5-chloro-2-methylpyridine;5-chloro-2-methylpyridine-3-carboxamide;O-[(5-chloro-2-methyl-3-pyridinyl)sulfanyloxy]hydroxylamine;5-chloro-2-methylpyrimidine;3-fluoro-2-methylpyridine;5-fluoro-2-methylpyrimidine;5-methoxy-2-methylpyridine;5-methylpyridazin-3-amine;4-methylpyridazine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;5-methylpyridin-2-amine;6-methylpyridin-3-amine;6-methylpyridin-3-ol;6-methylpyrimidin-4-amine

5-bromo-2-methylpyridine;5-bromo-2-methylpyrimidine;bis(2-chloro-4-fluoro-5-methylpyridine);4-chloro-5-fluoro-2-methylpyridine;5-chloro-4-fluoro-2-methylpyridine;5-chloro-3-isocyano-2-methylpyridine;5-chloro-2-methyl-3-methylperoxysulfanylpyridine;5-chloro-2-methylpyridin-4-amine;bis(2-chloro-5-methylpyridine);5-chloro-2-methylpyridine;5-chloro-2-methylpyridine-3-carboxamide;O-[(5-chloro-2-methyl-3-pyridinyl)sulfanyloxy]hydroxylamine;5-chloro-2-methylpyrimidine;3-fluoro-2-methylpyridine;5-fluoro-2-methylpyrimidine;5-methoxy-2-methylpyridine;5-methylpyridazin-3-amine;4-methylpyridazine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;5-methylpyridin-2-amine;6-methylpyridin-3-amine;6-methylpyridin-3-ol;6-methylpyrimidin-4-amine (PubChem CID 162183764) has the molecular formula C154H167Br2Cl13F6N42O7S2 and a molecular weight of 3517.14 g/mol. Its IUPAC name is 5-bromo-2-methylpyridine;5-bromo-2-methylpyrimidine;bis(2-chloro-4-fluoro-5-methylpyridine);4-chloro-5-fluoro-2-methylpyridine;5-chloro-4-fluoro-2-methylpyridine;5-chloro-3-isocyano-2-methylpyridine;5-chloro-2-methyl-3-methylperoxysulfanylpyridine;5-chloro-2-methylpyridin-4-amine;bis(2-chloro-5-methylpyridine);5-chloro-2-methylpyridine;5-chloro-2-methylpyridine-3-carboxamide;O-[(5-chloro-2-methyl-3-pyridinyl)sulfanyloxy]hydroxylamine;5-chloro-2-methylpyrimidine;3-fluoro-2-methylpyridine;5-fluoro-2-methylpyrimidine;5-methoxy-2-methylpyridine;5-methylpyridazin-3-amine;4-methylpyridazine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;5-methylpyridin-2-amine;6-methylpyridin-3-amine;6-methylpyridin-3-ol;6-methylpyrimidin-4-amine.

Molecular Properties

• Compound Name: 5-bromo-2-methylpyridine;5-bromo-2-methylpyrimidine;bis(2-chloro-4-fluoro-5-methylpyridine);4-chloro-5-fluoro-2-methylpyridine;5-chloro-4-fluoro-2-methylpyridine;5-chloro-3-isocyano-2-methylpyridine;5-chloro-2-methyl-3-methylperoxysulfanylpyridine;5-chloro-2-methylpyridin-4-amine;bis(2-chloro-5-methylpyridine);5-chloro-2-methylpyridine;5-chloro-2-methylpyridine-3-carboxamide;O-[(5-chloro-2-methyl-3-pyridinyl)sulfanyloxy]hydroxylamine;5-chloro-2-methylpyrimidine;3-fluoro-2-methylpyridine;5-fluoro-2-methylpyrimidine;5-methoxy-2-methylpyridine;5-methylpyridazin-3-amine;4-methylpyridazine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;5-methylpyridin-2-amine;6-methylpyridin-3-amine;6-methylpyridin-3-ol;6-methylpyrimidin-4-amine
• PubChem CID: 162183764
• Molecular Formula: C154H167Br2Cl13F6N42O7S2
• Molecular Weight: 3517.14 g/mol
• Exact Mass: 3506.77
• IUPAC Name: 5-bromo-2-methylpyridine;5-bromo-2-methylpyrimidine;bis(2-chloro-4-fluoro-5-methylpyridine);4-chloro-5-fluoro-2-methylpyridine;5-chloro-4-fluoro-2-methylpyridine;5-chloro-3-isocyano-2-methylpyridine;5-chloro-2-methyl-3-methylperoxysulfanylpyridine;5-chloro-2-methylpyridin-4-amine;bis(2-chloro-5-methylpyridine);5-chloro-2-methylpyridine;5-chloro-2-methylpyridine-3-carboxamide;O-[(5-chloro-2-methyl-3-pyridinyl)sulfanyloxy]hydroxylamine;5-chloro-2-methylpyrimidine;3-fluoro-2-methylpyridine;5-fluoro-2-methylpyrimidine;5-methoxy-2-methylpyridine;5-methylpyridazin-3-amine;4-methylpyridazine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;5-methylpyridin-2-amine;6-methylpyridin-3-amine;6-methylpyridin-3-ol;6-methylpyrimidin-4-amine
• SMILES: COOSc1cc(Cl)cnc1C.COc1ccc(C)nc1.Cc1cc(Cl)c(F)cn1.Cc1cc(F)c(Cl)cn1.Cc1cc(N)c(Cl)cn1.Cc1cc(N)ccn1.Cc1cc(N)ncn1.Cc1ccc(Br)cn1.Cc1ccc(Cl)cn1.Cc1ccc(Cl)nc1.Cc1ccc(Cl)nc1.Cc1ccc(N)cn1.Cc1ccc(N)nc1.Cc1ccc(O)cn1.Cc1ccnc(N)c1.Cc1ccnnc1.Cc1cnc(Cl)cc1F.Cc1cnc(Cl)cc1F.Cc1cnnc(N)c1.Cc1ncc(Br)cn1.Cc1ncc(Cl)cc1C(N)=O.Cc1ncc(Cl)cc1SOON.Cc1ncc(Cl)cn1.Cc1ncc(F)cn1.Cc1ncccc1F.[C-]#[N+]c1cc(Cl)cnc1C
• InChI: InChI=1S/C7H7ClN2O.C7H5ClN2.C7H8ClNO2S.C7H9NO.C6H6BrN.4C6H5ClFN.C6H7ClN2O2S.C6H7ClN2.3C6H6ClN.C6H6FN.4C6H8N2.C6H7NO.C5H5BrN2.C5H5ClN2.C5H5FN2.2C5H7N3.C5H6N2/c1-4-6(7(9)11)2-5(8)3-10-4;1-5-7(9-2)3-6(8)4-10-5;1-5-7(12-11-10-2)3-6(8)4-9-5;1-6-3-4-7(9-2)5-8-6;1-5-2-3-6(7)4-8-5;2*1-4-3-9-6(7)2-5(4)8;1-4-2-6(8)5(7)3-9-4;1-4-2-5(7)6(8)3-9-4;1-4-6(12-11-10-8)2-5(7)3-9-4;1-4-2-6(8)5(7)3-9-4;1-5-2-3-6(7)4-8-5;2*1-5-2-3-6(7)8-4-5;1-5-6(7)3-2-4-8-5;1-5-4-6(7)2-3-8-5;1-5-2-3-6(7)4-8-5;1-5-2-3-8-6(7)4-5;1-5-2-3-6(7)8-4-5;1-5-2-3-6(8)4-7-5;3*1-4-7-2-5(6)3-8-4;1-4-2-5(6)8-3-7-4;1-4-2-5(6)8-7-3-4;1-5-2-3-6-7-4-5/h2-3H,1H3,(H2,9,11);3-4H,1H3;3-4H,1-2H3;3-5H,1-2H3;2-4H,1H3;4*2-3H,1H3;2-3H,8H2,1H3;2-3H,1H3,(H2,8,9);4*2-4H,1H3;2-4H,1H3,(H2,7,8);2-4H,7H2,1H3;2*2-4H,1H3,(H2,7,8);2-4,8H,1H3;3*2-3H,1H3;2-3H,1H3,(H2,6,7,8);2-3H,1H3,(H2,6,8);2-4H,1H3
• InChIKey: ZPJSSKWQMKOAPS-UHFFFAOYSA-N
• XLogP: 40.22
• TPSA: 734.47 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 49
• Rotatable Bonds: 8
• Heavy Atoms: 226
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3517.14
LogP ≤ 5	40.22
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	49

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}, {'alert_name': 'sulfur_oxygen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-methylpyridine;5-bromo-2-methylpyrimidine;bis(2-chloro-4-fluoro-5-methylpyridine);4-chloro-5-fluoro-2-methylpyridine;5-chloro-4-fluoro-2-methylpyridine;5-chloro-3-isocyano-2-methylpyridine;5-chloro-2-methyl-3-methylperoxysulfanylpyridine;5-chloro-2-methylpyridin-4-amine;bis(2-chloro-5-methylpyridine);5-chloro-2-methylpyridine;5-chloro-2-methylpyridine-3-carboxamide;O-[(5-chloro-2-methyl-3-pyridinyl)sulfanyloxy]hydroxylamine;5-chloro-2-methylpyrimidine;3-fluoro-2-methylpyridine;5-fluoro-2-methylpyrimidine;5-methoxy-2-methylpyridine;5-methylpyridazin-3-amine;4-methylpyridazine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;5-methylpyridin-2-amine;6-methylpyridin-3-amine;6-methylpyridin-3-ol;6-methylpyrimidin-4-amine?

The IUPAC name of 5-bromo-2-methylpyridine;5-bromo-2-methylpyrimidine;bis(2-chloro-4-fluoro-5-methylpyridine);4-chloro-5-fluoro-2-methylpyridine;5-chloro-4-fluoro-2-methylpyridine;5-chloro-3-isocyano-2-methylpyridine;5-chloro-2-methyl-3-methylperoxysulfanylpyridine;5-chloro-2-methylpyridin-4-amine;bis(2-chloro-5-methylpyridine);5-chloro-2-methylpyridine;5-chloro-2-methylpyridine-3-carboxamide;O-[(5-chloro-2-methyl-3-pyridinyl)sulfanyloxy]hydroxylamine;5-chloro-2-methylpyrimidine;3-fluoro-2-methylpyridine;5-fluoro-2-methylpyrimidine;5-methoxy-2-methylpyridine;5-methylpyridazin-3-amine;4-methylpyridazine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;5-methylpyridin-2-amine;6-methylpyridin-3-amine;6-methylpyridin-3-ol;6-methylpyrimidin-4-amine (CID 162183764) is 5-bromo-2-methylpyridine;5-bromo-2-methylpyrimidine;bis(2-chloro-4-fluoro-5-methylpyridine);4-chloro-5-fluoro-2-methylpyridine;5-chloro-4-fluoro-2-methylpyridine;5-chloro-3-isocyano-2-methylpyridine;5-chloro-2-methyl-3-methylperoxysulfanylpyridine;5-chloro-2-methylpyridin-4-amine;bis(2-chloro-5-methylpyridine);5-chloro-2-methylpyridine;5-chloro-2-methylpyridine-3-carboxamide;O-[(5-chloro-2-methyl-3-pyridinyl)sulfanyloxy]hydroxylamine;5-chloro-2-methylpyrimidine;3-fluoro-2-methylpyridine;5-fluoro-2-methylpyrimidine;5-methoxy-2-methylpyridine;5-methylpyridazin-3-amine;4-methylpyridazine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;5-methylpyridin-2-amine;6-methylpyridin-3-amine;6-methylpyridin-3-ol;6-methylpyrimidin-4-amine.

What is the SMILES notation for 5-bromo-2-methylpyridine;5-bromo-2-methylpyrimidine;bis(2-chloro-4-fluoro-5-methylpyridine);4-chloro-5-fluoro-2-methylpyridine;5-chloro-4-fluoro-2-methylpyridine;5-chloro-3-isocyano-2-methylpyridine;5-chloro-2-methyl-3-methylperoxysulfanylpyridine;5-chloro-2-methylpyridin-4-amine;bis(2-chloro-5-methylpyridine);5-chloro-2-methylpyridine;5-chloro-2-methylpyridine-3-carboxamide;O-[(5-chloro-2-methyl-3-pyridinyl)sulfanyloxy]hydroxylamine;5-chloro-2-methylpyrimidine;3-fluoro-2-methylpyridine;5-fluoro-2-methylpyrimidine;5-methoxy-2-methylpyridine;5-methylpyridazin-3-amine;4-methylpyridazine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;5-methylpyridin-2-amine;6-methylpyridin-3-amine;6-methylpyridin-3-ol;6-methylpyrimidin-4-amine?

The canonical SMILES for 5-bromo-2-methylpyridine;5-bromo-2-methylpyrimidine;bis(2-chloro-4-fluoro-5-methylpyridine);4-chloro-5-fluoro-2-methylpyridine;5-chloro-4-fluoro-2-methylpyridine;5-chloro-3-isocyano-2-methylpyridine;5-chloro-2-methyl-3-methylperoxysulfanylpyridine;5-chloro-2-methylpyridin-4-amine;bis(2-chloro-5-methylpyridine);5-chloro-2-methylpyridine;5-chloro-2-methylpyridine-3-carboxamide;O-[(5-chloro-2-methyl-3-pyridinyl)sulfanyloxy]hydroxylamine;5-chloro-2-methylpyrimidine;3-fluoro-2-methylpyridine;5-fluoro-2-methylpyrimidine;5-methoxy-2-methylpyridine;5-methylpyridazin-3-amine;4-methylpyridazine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;5-methylpyridin-2-amine;6-methylpyridin-3-amine;6-methylpyridin-3-ol;6-methylpyrimidin-4-amine is COOSc1cc(Cl)cnc1C.COc1ccc(C)nc1.Cc1cc(Cl)c(F)cn1.Cc1cc(F)c(Cl)cn1.Cc1cc(N)c(Cl)cn1.Cc1cc(N)ccn1.Cc1cc(N)ncn1.Cc1ccc(Br)cn1.Cc1ccc(Cl)cn1.Cc1ccc(Cl)nc1.Cc1ccc(Cl)nc1.Cc1ccc(N)cn1.Cc1ccc(N)nc1.Cc1ccc(O)cn1.Cc1ccnc(N)c1.Cc1ccnnc1.Cc1cnc(Cl)cc1F.Cc1cnc(Cl)cc1F.Cc1cnnc(N)c1.Cc1ncc(Br)cn1.Cc1ncc(Cl)cc1C(N)=O.Cc1ncc(Cl)cc1SOON.Cc1ncc(Cl)cn1.Cc1ncc(F)cn1.Cc1ncccc1F.[C-]#[N+]c1cc(Cl)cnc1C.

What is the InChIKey of 5-bromo-2-methylpyridine;5-bromo-2-methylpyrimidine;bis(2-chloro-4-fluoro-5-methylpyridine);4-chloro-5-fluoro-2-methylpyridine;5-chloro-4-fluoro-2-methylpyridine;5-chloro-3-isocyano-2-methylpyridine;5-chloro-2-methyl-3-methylperoxysulfanylpyridine;5-chloro-2-methylpyridin-4-amine;bis(2-chloro-5-methylpyridine);5-chloro-2-methylpyridine;5-chloro-2-methylpyridine-3-carboxamide;O-[(5-chloro-2-methyl-3-pyridinyl)sulfanyloxy]hydroxylamine;5-chloro-2-methylpyrimidine;3-fluoro-2-methylpyridine;5-fluoro-2-methylpyrimidine;5-methoxy-2-methylpyridine;5-methylpyridazin-3-amine;4-methylpyridazine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;5-methylpyridin-2-amine;6-methylpyridin-3-amine;6-methylpyridin-3-ol;6-methylpyrimidin-4-amine?

The InChIKey is ZPJSSKWQMKOAPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClN2O.C7H5ClN2.C7H8ClNO2S.C7H9NO.C6H6BrN.4C6H5ClFN.C6H7ClN2O2S.C6H7ClN2.3C6H6ClN.C6H6FN.4C6H8N2.C6H7NO.C5H5BrN2.C5H5ClN2.C5H5FN2.2C5H7N3.C5H6N2/c1-4-6(7(9)11)2-5(8)3-10-4;1-5-7(9-2)3-6(8)4-10-5;1-5-7(12-11-10-2)3-6(8)4-9-5;1-6-3-4-7(9-2)5-8-6;1-5-2-3-6(7)4-8-5;2*1-4-3-9-6(7)2-5(4)8;1-4-2-6(8)5(7)3-9-4;1-4-2-5(7)6(8)3-9-4;1-4-6(12-11-10-8)2-5(7)3-9-4;1-4-2-6(8)5(7)3-9-4;1-5-2-3-6(7)4-8-5;2*1-5-2-3-6(7)8-4-5;1-5-6(7)3-2-4-8-5;1-5-4-6(7)2-3-8-5;1-5-2-3-6(7)4-8-5;1-5-2-3-8-6(7)4-5;1-5-2-3-6(7)8-4-5;1-5-2-3-6(8)4-7-5;3*1-4-7-2-5(6)3-8-4;1-4-2-5(6)8-3-7-4;1-4-2-5(6)8-7-3-4;1-5-2-3-6-7-4-5/h2-3H,1H3,(H2,9,11);3-4H,1H3;3-4H,1-2H3;3-5H,1-2H3;2-4H,1H3;4*2-3H,1H3;2-3H,8H2,1H3;2-3H,1H3,(H2,8,9);4*2-4H,1H3;2-4H,1H3,(H2,7,8);2-4H,7H2,1H3;2*2-4H,1H3,(H2,7,8);2-4,8H,1H3;3*2-3H,1H3;2-3H,1H3,(H2,6,7,8);2-3H,1H3,(H2,6,8);2-4H,1H3.

What are the key properties of 5-bromo-2-methylpyridine;5-bromo-2-methylpyrimidine;bis(2-chloro-4-fluoro-5-methylpyridine);4-chloro-5-fluoro-2-methylpyridine;5-chloro-4-fluoro-2-methylpyridine;5-chloro-3-isocyano-2-methylpyridine;5-chloro-2-methyl-3-methylperoxysulfanylpyridine;5-chloro-2-methylpyridin-4-amine;bis(2-chloro-5-methylpyridine);5-chloro-2-methylpyridine;5-chloro-2-methylpyridine-3-carboxamide;O-[(5-chloro-2-methyl-3-pyridinyl)sulfanyloxy]hydroxylamine;5-chloro-2-methylpyrimidine;3-fluoro-2-methylpyridine;5-fluoro-2-methylpyrimidine;5-methoxy-2-methylpyridine;5-methylpyridazin-3-amine;4-methylpyridazine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;5-methylpyridin-2-amine;6-methylpyridin-3-amine;6-methylpyridin-3-ol;6-methylpyrimidin-4-amine?

5-bromo-2-methylpyridine;5-bromo-2-methylpyrimidine;bis(2-chloro-4-fluoro-5-methylpyridine);4-chloro-5-fluoro-2-methylpyridine;5-chloro-4-fluoro-2-methylpyridine;5-chloro-3-isocyano-2-methylpyridine;5-chloro-2-methyl-3-methylperoxysulfanylpyridine;5-chloro-2-methylpyridin-4-amine;bis(2-chloro-5-methylpyridine);5-chloro-2-methylpyridine;5-chloro-2-methylpyridine-3-carboxamide;O-[(5-chloro-2-methyl-3-pyridinyl)sulfanyloxy]hydroxylamine;5-chloro-2-methylpyrimidine;3-fluoro-2-methylpyridine;5-fluoro-2-methylpyrimidine;5-methoxy-2-methylpyridine;5-methylpyridazin-3-amine;4-methylpyridazine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;5-methylpyridin-2-amine;6-methylpyridin-3-amine;6-methylpyridin-3-ol;6-methylpyrimidin-4-amine has a molecular weight of 3517.14 g/mol, XLogP of 40.22, 8 rotatable bonds, 10 hydrogen bond donors, and 49 hydrogen bond acceptors.

Where does this data come from?

All data for 5-bromo-2-methylpyridine;5-bromo-2-methylpyrimidine;bis(2-chloro-4-fluoro-5-methylpyridine);4-chloro-5-fluoro-2-methylpyridine;5-chloro-4-fluoro-2-methylpyridine;5-chloro-3-isocyano-2-methylpyridine;5-chloro-2-methyl-3-methylperoxysulfanylpyridine;5-chloro-2-methylpyridin-4-amine;bis(2-chloro-5-methylpyridine);5-chloro-2-methylpyridine;5-chloro-2-methylpyridine-3-carboxamide;O-[(5-chloro-2-methyl-3-pyridinyl)sulfanyloxy]hydroxylamine;5-chloro-2-methylpyrimidine;3-fluoro-2-methylpyridine;5-fluoro-2-methylpyrimidine;5-methoxy-2-methylpyridine;5-methylpyridazin-3-amine;4-methylpyridazine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;5-methylpyridin-2-amine;6-methylpyridin-3-amine;6-methylpyridin-3-ol;6-methylpyrimidin-4-amine is sourced from PubChem (CID 162183764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).