2-aminopyridine-3-sulfonamide;N-[(2-amino-3-pyridinyl)sulfonyl]-2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxamide;2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxylic acid;molecular hydrogen

C38H52Cl2N10O9S2 — CID 161487676

About 2-aminopyridine-3-sulfonamide;N-[(2-amino-3-pyridinyl)sulfonyl]-2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxamide;2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxylic acid;molecular hydrogen

2-aminopyridine-3-sulfonamide;N-[(2-amino-3-pyridinyl)sulfonyl]-2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxamide;2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxylic acid;molecular hydrogen (PubChem CID 161487676) has the molecular formula C38H52Cl2N10O9S2 and a molecular weight of 927.94 g/mol. Its IUPAC name is 2-aminopyridine-3-sulfonamide;N-[(2-amino-3-pyridinyl)sulfonyl]-2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxamide;2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxylic acid;molecular hydrogen.

Molecular Properties

• Compound Name: 2-aminopyridine-3-sulfonamide;N-[(2-amino-3-pyridinyl)sulfonyl]-2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxamide;2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxylic acid;molecular hydrogen
• PubChem CID: 161487676
• Molecular Formula: C38H52Cl2N10O9S2
• Molecular Weight: 927.94 g/mol
• Exact Mass: 926.27
• IUPAC Name: 2-aminopyridine-3-sulfonamide;N-[(2-amino-3-pyridinyl)sulfonyl]-2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxamide;2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxylic acid;molecular hydrogen
• SMILES: CCOc1cc(C)cc(-c2ccc(C(=O)NS(=O)(=O)c3cccnc3N)c(Cl)n2)n1.CCOc1cc(C)cc(-c2ccc(C(=O)O)c(Cl)n2)n1.Nc1ncccc1S(N)(=O)=O.[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H]
• InChI: InChI=1S/C19H18ClN5O4S.C14H13ClN2O3.C5H7N3O2S.7H2/c1-3-29-16-10-11(2)9-14(23-16)13-7-6-12(17(20)24-13)19(26)25-30(27,28)15-5-4-8-22-18(15)21;1-3-20-12-7-8(2)6-11(16-12)10-5-4-9(14(18)19)13(15)17-10;6-5-4(11(7,9)10)2-1-3-8-5;;;;;;;/h4-10H,3H2,1-2H3,(H2,21,22)(H,25,26);4-7H,3H2,1-2H3,(H,18,19);1-3H,(H2,6,8)(H2,7,9,10);7*1H
• InChIKey: WFELYTBUAUNDAJ-UHFFFAOYSA-N
• XLogP: 6.84
• TPSA: 308.54 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 16
• Rotatable Bonds: 11
• Heavy Atoms: 61
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	927.94
LogP ≤ 5	6.84
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-aminopyridine-3-sulfonamide;N-[(2-amino-3-pyridinyl)sulfonyl]-2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxamide;2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxylic acid;molecular hydrogen?

The IUPAC name of 2-aminopyridine-3-sulfonamide;N-[(2-amino-3-pyridinyl)sulfonyl]-2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxamide;2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxylic acid;molecular hydrogen (CID 161487676) is 2-aminopyridine-3-sulfonamide;N-[(2-amino-3-pyridinyl)sulfonyl]-2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxamide;2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxylic acid;molecular hydrogen.

What is the SMILES notation for 2-aminopyridine-3-sulfonamide;N-[(2-amino-3-pyridinyl)sulfonyl]-2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxamide;2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxylic acid;molecular hydrogen?

The canonical SMILES for 2-aminopyridine-3-sulfonamide;N-[(2-amino-3-pyridinyl)sulfonyl]-2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxamide;2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxylic acid;molecular hydrogen is CCOc1cc(C)cc(-c2ccc(C(=O)NS(=O)(=O)c3cccnc3N)c(Cl)n2)n1.CCOc1cc(C)cc(-c2ccc(C(=O)O)c(Cl)n2)n1.Nc1ncccc1S(N)(=O)=O.[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].

What is the InChIKey of 2-aminopyridine-3-sulfonamide;N-[(2-amino-3-pyridinyl)sulfonyl]-2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxamide;2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxylic acid;molecular hydrogen?

The InChIKey is WFELYTBUAUNDAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClN5O4S.C14H13ClN2O3.C5H7N3O2S.7H2/c1-3-29-16-10-11(2)9-14(23-16)13-7-6-12(17(20)24-13)19(26)25-30(27,28)15-5-4-8-22-18(15)21;1-3-20-12-7-8(2)6-11(16-12)10-5-4-9(14(18)19)13(15)17-10;6-5-4(11(7,9)10)2-1-3-8-5;;;;;;;/h4-10H,3H2,1-2H3,(H2,21,22)(H,25,26);4-7H,3H2,1-2H3,(H,18,19);1-3H,(H2,6,8)(H2,7,9,10);7*1H.

What are the key properties of 2-aminopyridine-3-sulfonamide;N-[(2-amino-3-pyridinyl)sulfonyl]-2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxamide;2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxylic acid;molecular hydrogen?

2-aminopyridine-3-sulfonamide;N-[(2-amino-3-pyridinyl)sulfonyl]-2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxamide;2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxylic acid;molecular hydrogen has a molecular weight of 927.94 g/mol, XLogP of 6.84, 11 rotatable bonds, 5 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 2-aminopyridine-3-sulfonamide;N-[(2-amino-3-pyridinyl)sulfonyl]-2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxamide;2-chloro-6-(6-ethoxy-4-methyl-2-pyridinyl)pyridine-3-carboxylic acid;molecular hydrogen is sourced from PubChem (CID 161487676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).