5-bromo-2-chloro-N-[2-(ethylamino)-3-pyridinyl]pyridine-3-carboxamide;13-bromo-2-ethyl-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;13-bromo-2-ethyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-chloro-3-nitropyridine;2-ethyl-13-(2-hydroxyethyl)-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-ethyl-9-methyl-13-prop-2-enyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;N-ethyl-3-nitropyridin-2-amine;2-N-ethylpyridine-2,3-diamine

C92H95Br3Cl2N28O10 — CID 162006151

About 5-bromo-2-chloro-N-[2-(ethylamino)-3-pyridinyl]pyridine-3-carboxamide;13-bromo-2-ethyl-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;13-bromo-2-ethyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-chloro-3-nitropyridine;2-ethyl-13-(2-hydroxyethyl)-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-ethyl-9-methyl-13-prop-2-enyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;N-ethyl-3-nitropyridin-2-amine;2-N-ethylpyridine-2,3-diamine

5-bromo-2-chloro-N-[2-(ethylamino)-3-pyridinyl]pyridine-3-carboxamide;13-bromo-2-ethyl-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;13-bromo-2-ethyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-chloro-3-nitropyridine;2-ethyl-13-(2-hydroxyethyl)-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-ethyl-9-methyl-13-prop-2-enyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;N-ethyl-3-nitropyridin-2-amine;2-N-ethylpyridine-2,3-diamine (PubChem CID 162006151) has the molecular formula C92H95Br3Cl2N28O10 and a molecular weight of 2063.58 g/mol. Its IUPAC name is 5-bromo-2-chloro-N-[2-(ethylamino)-3-pyridinyl]pyridine-3-carboxamide;13-bromo-2-ethyl-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;13-bromo-2-ethyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-chloro-3-nitropyridine;2-ethyl-13-(2-hydroxyethyl)-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-ethyl-9-methyl-13-prop-2-enyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;N-ethyl-3-nitropyridin-2-amine;2-N-ethylpyridine-2,3-diamine.

Molecular Properties

• Compound Name: 5-bromo-2-chloro-N-[2-(ethylamino)-3-pyridinyl]pyridine-3-carboxamide;13-bromo-2-ethyl-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;13-bromo-2-ethyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-chloro-3-nitropyridine;2-ethyl-13-(2-hydroxyethyl)-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-ethyl-9-methyl-13-prop-2-enyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;N-ethyl-3-nitropyridin-2-amine;2-N-ethylpyridine-2,3-diamine
• PubChem CID: 162006151
• Molecular Formula: C92H95Br3Cl2N28O10
• Molecular Weight: 2063.58 g/mol
• Exact Mass: 2058.47
• IUPAC Name: 5-bromo-2-chloro-N-[2-(ethylamino)-3-pyridinyl]pyridine-3-carboxamide;13-bromo-2-ethyl-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;13-bromo-2-ethyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-chloro-3-nitropyridine;2-ethyl-13-(2-hydroxyethyl)-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-ethyl-9-methyl-13-prop-2-enyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;N-ethyl-3-nitropyridin-2-amine;2-N-ethylpyridine-2,3-diamine
• SMILES: C=CCc1cnc2c(c1)C(=O)N(C)c1cccnc1N2CC.CCN1c2ncc(Br)cc2C(=O)N(C)c2cccnc21.CCN1c2ncc(CCO)cc2C(=O)N(C)c2cccnc21.CCN1c2ncccc2NC(=O)c2cc(Br)cnc21.CCNc1ncccc1N.CCNc1ncccc1NC(=O)c1cc(Br)cnc1Cl.CCNc1ncccc1[N+](=O)[O-].O=[N+]([O-])c1cccnc1Cl
• InChI: InChI=1S/C17H18N4O.C16H18N4O2.C14H13BrN4O.C13H12BrClN4O.C13H11BrN4O.C7H9N3O2.C7H11N3.C5H3ClN2O2/c1-4-7-12-10-13-15(19-11-12)21(5-2)16-14(8-6-9-18-16)20(3)17(13)22;1-3-20-14-12(9-11(6-8-21)10-18-14)16(22)19(2)13-5-4-7-17-15(13)20;1-3-19-12-10(7-9(15)8-17-12)14(20)18(2)11-5-4-6-16-13(11)19;1-2-16-12-10(4-3-5-17-12)19-13(20)9-6-8(14)7-18-11(9)15;1-2-18-11-9(6-8(14)7-16-11)13(19)17-10-4-3-5-15-12(10)18;1-2-8-7-6(10(11)12)4-3-5-9-7;1-2-9-7-6(8)4-3-5-10-7;6-5-4(8(9)10)2-1-3-7-5/h4,6,8-11H,1,5,7H2,2-3H3;4-5,7,9-10,21H,3,6,8H2,1-2H3;4-8H,3H2,1-2H3;3-7H,2H2,1H3,(H,16,17)(H,19,20);3-7H,2H2,1H3,(H,17,19);3-5H,2H2,1H3,(H,8,9);3-5H,2,8H2,1H3,(H,9,10);1-3H
• InChIKey: YSWAYJIEDCNHOR-UHFFFAOYSA-N
• XLogP: 18.40
• TPSA: 468.28 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 31
• Rotatable Bonds: 18
• Heavy Atoms: 135
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2063.58
LogP ≤ 5	18.40
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-chloro-N-[2-(ethylamino)-3-pyridinyl]pyridine-3-carboxamide;13-bromo-2-ethyl-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;13-bromo-2-ethyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-chloro-3-nitropyridine;2-ethyl-13-(2-hydroxyethyl)-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-ethyl-9-methyl-13-prop-2-enyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;N-ethyl-3-nitropyridin-2-amine;2-N-ethylpyridine-2,3-diamine?

The IUPAC name of 5-bromo-2-chloro-N-[2-(ethylamino)-3-pyridinyl]pyridine-3-carboxamide;13-bromo-2-ethyl-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;13-bromo-2-ethyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-chloro-3-nitropyridine;2-ethyl-13-(2-hydroxyethyl)-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-ethyl-9-methyl-13-prop-2-enyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;N-ethyl-3-nitropyridin-2-amine;2-N-ethylpyridine-2,3-diamine (CID 162006151) is 5-bromo-2-chloro-N-[2-(ethylamino)-3-pyridinyl]pyridine-3-carboxamide;13-bromo-2-ethyl-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;13-bromo-2-ethyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-chloro-3-nitropyridine;2-ethyl-13-(2-hydroxyethyl)-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-ethyl-9-methyl-13-prop-2-enyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;N-ethyl-3-nitropyridin-2-amine;2-N-ethylpyridine-2,3-diamine.

What is the SMILES notation for 5-bromo-2-chloro-N-[2-(ethylamino)-3-pyridinyl]pyridine-3-carboxamide;13-bromo-2-ethyl-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;13-bromo-2-ethyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-chloro-3-nitropyridine;2-ethyl-13-(2-hydroxyethyl)-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-ethyl-9-methyl-13-prop-2-enyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;N-ethyl-3-nitropyridin-2-amine;2-N-ethylpyridine-2,3-diamine?

The canonical SMILES for 5-bromo-2-chloro-N-[2-(ethylamino)-3-pyridinyl]pyridine-3-carboxamide;13-bromo-2-ethyl-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;13-bromo-2-ethyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-chloro-3-nitropyridine;2-ethyl-13-(2-hydroxyethyl)-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-ethyl-9-methyl-13-prop-2-enyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;N-ethyl-3-nitropyridin-2-amine;2-N-ethylpyridine-2,3-diamine is C=CCc1cnc2c(c1)C(=O)N(C)c1cccnc1N2CC.CCN1c2ncc(Br)cc2C(=O)N(C)c2cccnc21.CCN1c2ncc(CCO)cc2C(=O)N(C)c2cccnc21.CCN1c2ncccc2NC(=O)c2cc(Br)cnc21.CCNc1ncccc1N.CCNc1ncccc1NC(=O)c1cc(Br)cnc1Cl.CCNc1ncccc1[N+](=O)[O-].O=[N+]([O-])c1cccnc1Cl.

What is the InChIKey of 5-bromo-2-chloro-N-[2-(ethylamino)-3-pyridinyl]pyridine-3-carboxamide;13-bromo-2-ethyl-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;13-bromo-2-ethyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-chloro-3-nitropyridine;2-ethyl-13-(2-hydroxyethyl)-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-ethyl-9-methyl-13-prop-2-enyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;N-ethyl-3-nitropyridin-2-amine;2-N-ethylpyridine-2,3-diamine?

The InChIKey is YSWAYJIEDCNHOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O.C16H18N4O2.C14H13BrN4O.C13H12BrClN4O.C13H11BrN4O.C7H9N3O2.C7H11N3.C5H3ClN2O2/c1-4-7-12-10-13-15(19-11-12)21(5-2)16-14(8-6-9-18-16)20(3)17(13)22;1-3-20-14-12(9-11(6-8-21)10-18-14)16(22)19(2)13-5-4-7-17-15(13)20;1-3-19-12-10(7-9(15)8-17-12)14(20)18(2)11-5-4-6-16-13(11)19;1-2-16-12-10(4-3-5-17-12)19-13(20)9-6-8(14)7-18-11(9)15;1-2-18-11-9(6-8(14)7-16-11)13(19)17-10-4-3-5-15-12(10)18;1-2-8-7-6(10(11)12)4-3-5-9-7;1-2-9-7-6(8)4-3-5-10-7;6-5-4(8(9)10)2-1-3-7-5/h4,6,8-11H,1,5,7H2,2-3H3;4-5,7,9-10,21H,3,6,8H2,1-2H3;4-8H,3H2,1-2H3;3-7H,2H2,1H3,(H,16,17)(H,19,20);3-7H,2H2,1H3,(H,17,19);3-5H,2H2,1H3,(H,8,9);3-5H,2,8H2,1H3,(H,9,10);1-3H.

What are the key properties of 5-bromo-2-chloro-N-[2-(ethylamino)-3-pyridinyl]pyridine-3-carboxamide;13-bromo-2-ethyl-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;13-bromo-2-ethyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-chloro-3-nitropyridine;2-ethyl-13-(2-hydroxyethyl)-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-ethyl-9-methyl-13-prop-2-enyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;N-ethyl-3-nitropyridin-2-amine;2-N-ethylpyridine-2,3-diamine?

5-bromo-2-chloro-N-[2-(ethylamino)-3-pyridinyl]pyridine-3-carboxamide;13-bromo-2-ethyl-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;13-bromo-2-ethyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-chloro-3-nitropyridine;2-ethyl-13-(2-hydroxyethyl)-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-ethyl-9-methyl-13-prop-2-enyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;N-ethyl-3-nitropyridin-2-amine;2-N-ethylpyridine-2,3-diamine has a molecular weight of 2063.58 g/mol, XLogP of 18.40, 18 rotatable bonds, 7 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 5-bromo-2-chloro-N-[2-(ethylamino)-3-pyridinyl]pyridine-3-carboxamide;13-bromo-2-ethyl-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;13-bromo-2-ethyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-chloro-3-nitropyridine;2-ethyl-13-(2-hydroxyethyl)-9-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;2-ethyl-9-methyl-13-prop-2-enyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one;N-ethyl-3-nitropyridin-2-amine;2-N-ethylpyridine-2,3-diamine is sourced from PubChem (CID 162006151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).