potassium;1H-benzimidazol-2-amine;bis(5-chloro-1-benzofuran-2-carbonyl chloride);5-chloro-1,3-benzoxazole-2-carboxylic acid;1-(2-chloroethyl)pyrrolidine;5-chloro-N-[1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]-1-benzofuran-2-carboxamide;N,N-diethylethanamine;methane;bis(1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-amine);thionyl dichloride;hydroxide

C94H108Cl9KN18O11S — CID 159246483

About potassium;1H-benzimidazol-2-amine;bis(5-chloro-1-benzofuran-2-carbonyl chloride);5-chloro-1,3-benzoxazole-2-carboxylic acid;1-(2-chloroethyl)pyrrolidine;5-chloro-N-[1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]-1-benzofuran-2-carboxamide;N,N-diethylethanamine;methane;bis(1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-amine);thionyl dichloride;hydroxide

potassium;1H-benzimidazol-2-amine;bis(5-chloro-1-benzofuran-2-carbonyl chloride);5-chloro-1,3-benzoxazole-2-carboxylic acid;1-(2-chloroethyl)pyrrolidine;5-chloro-N-[1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]-1-benzofuran-2-carboxamide;N,N-diethylethanamine;methane;bis(1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-amine);thionyl dichloride;hydroxide (PubChem CID 159246483) has the molecular formula C94H108Cl9KN18O11S and a molecular weight of 2056.25 g/mol. Its IUPAC name is potassium;1H-benzimidazol-2-amine;bis(5-chloro-1-benzofuran-2-carbonyl chloride);5-chloro-1,3-benzoxazole-2-carboxylic acid;1-(2-chloroethyl)pyrrolidine;5-chloro-N-[1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]-1-benzofuran-2-carboxamide;N,N-diethylethanamine;methane;bis(1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-amine);thionyl dichloride;hydroxide.

Molecular Properties

• Compound Name: potassium;1H-benzimidazol-2-amine;bis(5-chloro-1-benzofuran-2-carbonyl chloride);5-chloro-1,3-benzoxazole-2-carboxylic acid;1-(2-chloroethyl)pyrrolidine;5-chloro-N-[1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]-1-benzofuran-2-carboxamide;N,N-diethylethanamine;methane;bis(1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-amine);thionyl dichloride;hydroxide
• PubChem CID: 159246483
• Molecular Formula: C94H108Cl9KN18O11S
• Molecular Weight: 2056.25 g/mol
• Exact Mass: 2050.50
• IUPAC Name: potassium;1H-benzimidazol-2-amine;bis(5-chloro-1-benzofuran-2-carbonyl chloride);5-chloro-1,3-benzoxazole-2-carboxylic acid;1-(2-chloroethyl)pyrrolidine;5-chloro-N-[1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]-1-benzofuran-2-carboxamide;N,N-diethylethanamine;methane;bis(1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-amine);thionyl dichloride;hydroxide
• SMILES: C.CCN(CC)CC.ClCCN1CCCC1.Nc1nc2ccccc2[nH]1.Nc1nc2ccccc2n1CCN1CCCC1.Nc1nc2ccccc2n1CCN1CCCC1.O=C(Cl)c1cc2cc(Cl)ccc2o1.O=C(Cl)c1cc2cc(Cl)ccc2o1.O=C(Nc1nc2ccccc2n1CCN1CCCC1)c1cc2cc(Cl)ccc2o1.O=C(O)c1nc2cc(Cl)ccc2o1.O=S(Cl)Cl.[K+].[OH-]
• InChI: InChI=1S/C22H21ClN4O2.2C13H18N4.2C9H4Cl2O2.C8H4ClNO3.C7H7N3.C6H12ClN.C6H15N.CH4.Cl2OS.K.H2O/c23-16-7-8-19-15(13-16)14-20(29-19)21(28)25-22-24-17-5-1-2-6-18(17)27(22)12-11-26-9-3-4-10-26;2*14-13-15-11-5-1-2-6-12(11)17(13)10-9-16-7-3-4-8-16;2*10-6-1-2-7-5(3-6)4-8(13-7)9(11)12;9-4-1-2-6-5(3-4)10-7(13-6)8(11)12;8-7-9-5-3-1-2-4-6(5)10-7;7-3-6-8-4-1-2-5-8;1-4-7(5-2)6-3;;1-4(2)3;;/h1-2,5-8,13-14H,3-4,9-12H2,(H,24,25,28);2*1-2,5-6H,3-4,7-10H2,(H2,14,15);2*1-4H;1-3H,(H,11,12);1-4H,(H3,8,9,10);1-6H2;4-6H2,1-3H3;1H4;;;1H2/q;;;;;;;;;;;+1;/p-1
• InChIKey: KUSZMZIDDNEKRF-UHFFFAOYSA-M
• XLogP: 19.64
• TPSA: 389.46 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 26
• Rotatable Bonds: 19
• Heavy Atoms: 134
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2056.25
LogP ≤ 5	19.64
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acid_halide', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of potassium;1H-benzimidazol-2-amine;bis(5-chloro-1-benzofuran-2-carbonyl chloride);5-chloro-1,3-benzoxazole-2-carboxylic acid;1-(2-chloroethyl)pyrrolidine;5-chloro-N-[1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]-1-benzofuran-2-carboxamide;N,N-diethylethanamine;methane;bis(1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-amine);thionyl dichloride;hydroxide?

The IUPAC name of potassium;1H-benzimidazol-2-amine;bis(5-chloro-1-benzofuran-2-carbonyl chloride);5-chloro-1,3-benzoxazole-2-carboxylic acid;1-(2-chloroethyl)pyrrolidine;5-chloro-N-[1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]-1-benzofuran-2-carboxamide;N,N-diethylethanamine;methane;bis(1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-amine);thionyl dichloride;hydroxide (CID 159246483) is potassium;1H-benzimidazol-2-amine;bis(5-chloro-1-benzofuran-2-carbonyl chloride);5-chloro-1,3-benzoxazole-2-carboxylic acid;1-(2-chloroethyl)pyrrolidine;5-chloro-N-[1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]-1-benzofuran-2-carboxamide;N,N-diethylethanamine;methane;bis(1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-amine);thionyl dichloride;hydroxide.

What is the SMILES notation for potassium;1H-benzimidazol-2-amine;bis(5-chloro-1-benzofuran-2-carbonyl chloride);5-chloro-1,3-benzoxazole-2-carboxylic acid;1-(2-chloroethyl)pyrrolidine;5-chloro-N-[1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]-1-benzofuran-2-carboxamide;N,N-diethylethanamine;methane;bis(1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-amine);thionyl dichloride;hydroxide?

The canonical SMILES for potassium;1H-benzimidazol-2-amine;bis(5-chloro-1-benzofuran-2-carbonyl chloride);5-chloro-1,3-benzoxazole-2-carboxylic acid;1-(2-chloroethyl)pyrrolidine;5-chloro-N-[1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]-1-benzofuran-2-carboxamide;N,N-diethylethanamine;methane;bis(1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-amine);thionyl dichloride;hydroxide is C.CCN(CC)CC.ClCCN1CCCC1.Nc1nc2ccccc2[nH]1.Nc1nc2ccccc2n1CCN1CCCC1.Nc1nc2ccccc2n1CCN1CCCC1.O=C(Cl)c1cc2cc(Cl)ccc2o1.O=C(Cl)c1cc2cc(Cl)ccc2o1.O=C(Nc1nc2ccccc2n1CCN1CCCC1)c1cc2cc(Cl)ccc2o1.O=C(O)c1nc2cc(Cl)ccc2o1.O=S(Cl)Cl.[K+].[OH-].

What is the InChIKey of potassium;1H-benzimidazol-2-amine;bis(5-chloro-1-benzofuran-2-carbonyl chloride);5-chloro-1,3-benzoxazole-2-carboxylic acid;1-(2-chloroethyl)pyrrolidine;5-chloro-N-[1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]-1-benzofuran-2-carboxamide;N,N-diethylethanamine;methane;bis(1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-amine);thionyl dichloride;hydroxide?

The InChIKey is KUSZMZIDDNEKRF-UHFFFAOYSA-M. The full InChI is InChI=1S/C22H21ClN4O2.2C13H18N4.2C9H4Cl2O2.C8H4ClNO3.C7H7N3.C6H12ClN.C6H15N.CH4.Cl2OS.K.H2O/c23-16-7-8-19-15(13-16)14-20(29-19)21(28)25-22-24-17-5-1-2-6-18(17)27(22)12-11-26-9-3-4-10-26;2*14-13-15-11-5-1-2-6-12(11)17(13)10-9-16-7-3-4-8-16;2*10-6-1-2-7-5(3-6)4-8(13-7)9(11)12;9-4-1-2-6-5(3-4)10-7(13-6)8(11)12;8-7-9-5-3-1-2-4-6(5)10-7;7-3-6-8-4-1-2-5-8;1-4-7(5-2)6-3;;1-4(2)3;;/h1-2,5-8,13-14H,3-4,9-12H2,(H,24,25,28);2*1-2,5-6H,3-4,7-10H2,(H2,14,15);2*1-4H;1-3H,(H,11,12);1-4H,(H3,8,9,10);1-6H2;4-6H2,1-3H3;1H4;;;1H2/q;;;;;;;;;;;+1;/p-1.

What are the key properties of potassium;1H-benzimidazol-2-amine;bis(5-chloro-1-benzofuran-2-carbonyl chloride);5-chloro-1,3-benzoxazole-2-carboxylic acid;1-(2-chloroethyl)pyrrolidine;5-chloro-N-[1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]-1-benzofuran-2-carboxamide;N,N-diethylethanamine;methane;bis(1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-amine);thionyl dichloride;hydroxide?

potassium;1H-benzimidazol-2-amine;bis(5-chloro-1-benzofuran-2-carbonyl chloride);5-chloro-1,3-benzoxazole-2-carboxylic acid;1-(2-chloroethyl)pyrrolidine;5-chloro-N-[1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]-1-benzofuran-2-carboxamide;N,N-diethylethanamine;methane;bis(1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-amine);thionyl dichloride;hydroxide has a molecular weight of 2056.25 g/mol, XLogP of 19.64, 19 rotatable bonds, 6 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for potassium;1H-benzimidazol-2-amine;bis(5-chloro-1-benzofuran-2-carbonyl chloride);5-chloro-1,3-benzoxazole-2-carboxylic acid;1-(2-chloroethyl)pyrrolidine;5-chloro-N-[1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]-1-benzofuran-2-carboxamide;N,N-diethylethanamine;methane;bis(1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-amine);thionyl dichloride;hydroxide is sourced from PubChem (CID 159246483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).