N-[(E)-dimethylaminomethylideneamino]-6-(dimethylaminomethylideneamino)pyridine-2-carboxamide;2-methoxypyridine-3-carboxylic acid;2-methoxy-N-[6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]-2-pyridinyl]pyridine-3-carboxamide;1-(trifluoromethyl)cyclopropan-1-amine;6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]pyridin-2-amine

C52H56F9N19O6 — CID 172963785

About N-[(E)-dimethylaminomethylideneamino]-6-(dimethylaminomethylideneamino)pyridine-2-carboxamide;2-methoxypyridine-3-carboxylic acid;2-methoxy-N-[6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]-2-pyridinyl]pyridine-3-carboxamide;1-(trifluoromethyl)cyclopropan-1-amine;6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]pyridin-2-amine

N-[(E)-dimethylaminomethylideneamino]-6-(dimethylaminomethylideneamino)pyridine-2-carboxamide;2-methoxypyridine-3-carboxylic acid;2-methoxy-N-[6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]-2-pyridinyl]pyridine-3-carboxamide;1-(trifluoromethyl)cyclopropan-1-amine;6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]pyridin-2-amine (PubChem CID 172963785) has the molecular formula C52H56F9N19O6 and a molecular weight of 1214.13 g/mol. Its IUPAC name is N-[(E)-dimethylaminomethylideneamino]-6-(dimethylaminomethylideneamino)pyridine-2-carboxamide;2-methoxypyridine-3-carboxylic acid;2-methoxy-N-[6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]-2-pyridinyl]pyridine-3-carboxamide;1-(trifluoromethyl)cyclopropan-1-amine;6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]pyridin-2-amine.

Molecular Properties

• Compound Name: N-[(E)-dimethylaminomethylideneamino]-6-(dimethylaminomethylideneamino)pyridine-2-carboxamide;2-methoxypyridine-3-carboxylic acid;2-methoxy-N-[6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]-2-pyridinyl]pyridine-3-carboxamide;1-(trifluoromethyl)cyclopropan-1-amine;6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]pyridin-2-amine
• PubChem CID: 172963785
• Molecular Formula: C52H56F9N19O6
• Molecular Weight: 1214.13 g/mol
• Exact Mass: 1213.45
• IUPAC Name: N-[(E)-dimethylaminomethylideneamino]-6-(dimethylaminomethylideneamino)pyridine-2-carboxamide;2-methoxypyridine-3-carboxylic acid;2-methoxy-N-[6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]-2-pyridinyl]pyridine-3-carboxamide;1-(trifluoromethyl)cyclopropan-1-amine;6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]pyridin-2-amine
• SMILES: CN(C)C=Nc1cccc(C(=O)N/N=C/N(C)C)n1.COc1ncccc1C(=O)Nc1cccc(-c2nncn2C2(C(F)(F)F)CC2)n1.COc1ncccc1C(=O)O.NC1(C(F)(F)F)CC1.Nc1cccc(-c2nncn2C2(C(F)(F)F)CC2)n1
• InChI: InChI=1S/C18H15F3N6O2.C12H18N6O.C11H10F3N5.C7H7NO3.C4H6F3N/c1-29-16-11(4-3-9-22-16)15(28)25-13-6-2-5-12(24-13)14-26-23-10-27(14)17(7-8-17)18(19,20)21;1-17(2)8-13-11-7-5-6-10(15-11)12(19)16-14-9-18(3)4;12-11(13,14)10(4-5-10)19-6-16-18-9(19)7-2-1-3-8(15)17-7;1-11-6-5(7(9)10)3-2-4-8-6;5-4(6,7)3(8)1-2-3/h2-6,9-10H,7-8H2,1H3,(H,24,25,28);5-9H,1-4H3,(H,16,19);1-3,6H,4-5H2,(H2,15,17);2-4H,1H3,(H,9,10);1-2,8H2/b;13-8?,14-9+
• InChIKey: CBBOFABPRIFXSK-NBZNMJRUSA-N
• XLogP: 7.39
• TPSA: 323.07 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 20
• Rotatable Bonds: 14
• Heavy Atoms: 86
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1214.13
LogP ≤ 5	7.39
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[(E)-dimethylaminomethylideneamino]-6-(dimethylaminomethylideneamino)pyridine-2-carboxamide;2-methoxypyridine-3-carboxylic acid;2-methoxy-N-[6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]-2-pyridinyl]pyridine-3-carboxamide;1-(trifluoromethyl)cyclopropan-1-amine;6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]pyridin-2-amine?

The IUPAC name of N-[(E)-dimethylaminomethylideneamino]-6-(dimethylaminomethylideneamino)pyridine-2-carboxamide;2-methoxypyridine-3-carboxylic acid;2-methoxy-N-[6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]-2-pyridinyl]pyridine-3-carboxamide;1-(trifluoromethyl)cyclopropan-1-amine;6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]pyridin-2-amine (CID 172963785) is N-[(E)-dimethylaminomethylideneamino]-6-(dimethylaminomethylideneamino)pyridine-2-carboxamide;2-methoxypyridine-3-carboxylic acid;2-methoxy-N-[6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]-2-pyridinyl]pyridine-3-carboxamide;1-(trifluoromethyl)cyclopropan-1-amine;6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]pyridin-2-amine.

What is the SMILES notation for N-[(E)-dimethylaminomethylideneamino]-6-(dimethylaminomethylideneamino)pyridine-2-carboxamide;2-methoxypyridine-3-carboxylic acid;2-methoxy-N-[6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]-2-pyridinyl]pyridine-3-carboxamide;1-(trifluoromethyl)cyclopropan-1-amine;6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]pyridin-2-amine?

The canonical SMILES for N-[(E)-dimethylaminomethylideneamino]-6-(dimethylaminomethylideneamino)pyridine-2-carboxamide;2-methoxypyridine-3-carboxylic acid;2-methoxy-N-[6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]-2-pyridinyl]pyridine-3-carboxamide;1-(trifluoromethyl)cyclopropan-1-amine;6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]pyridin-2-amine is CN(C)C=Nc1cccc(C(=O)N/N=C/N(C)C)n1.COc1ncccc1C(=O)Nc1cccc(-c2nncn2C2(C(F)(F)F)CC2)n1.COc1ncccc1C(=O)O.NC1(C(F)(F)F)CC1.Nc1cccc(-c2nncn2C2(C(F)(F)F)CC2)n1.

What is the InChIKey of N-[(E)-dimethylaminomethylideneamino]-6-(dimethylaminomethylideneamino)pyridine-2-carboxamide;2-methoxypyridine-3-carboxylic acid;2-methoxy-N-[6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]-2-pyridinyl]pyridine-3-carboxamide;1-(trifluoromethyl)cyclopropan-1-amine;6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]pyridin-2-amine?

The InChIKey is CBBOFABPRIFXSK-NBZNMJRUSA-N. The full InChI is InChI=1S/C18H15F3N6O2.C12H18N6O.C11H10F3N5.C7H7NO3.C4H6F3N/c1-29-16-11(4-3-9-22-16)15(28)25-13-6-2-5-12(24-13)14-26-23-10-27(14)17(7-8-17)18(19,20)21;1-17(2)8-13-11-7-5-6-10(15-11)12(19)16-14-9-18(3)4;12-11(13,14)10(4-5-10)19-6-16-18-9(19)7-2-1-3-8(15)17-7;1-11-6-5(7(9)10)3-2-4-8-6;5-4(6,7)3(8)1-2-3/h2-6,9-10H,7-8H2,1H3,(H,24,25,28);5-9H,1-4H3,(H,16,19);1-3,6H,4-5H2,(H2,15,17);2-4H,1H3,(H,9,10);1-2,8H2/b;13-8?,14-9+;;;.

What are the key properties of N-[(E)-dimethylaminomethylideneamino]-6-(dimethylaminomethylideneamino)pyridine-2-carboxamide;2-methoxypyridine-3-carboxylic acid;2-methoxy-N-[6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]-2-pyridinyl]pyridine-3-carboxamide;1-(trifluoromethyl)cyclopropan-1-amine;6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]pyridin-2-amine?

N-[(E)-dimethylaminomethylideneamino]-6-(dimethylaminomethylideneamino)pyridine-2-carboxamide;2-methoxypyridine-3-carboxylic acid;2-methoxy-N-[6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]-2-pyridinyl]pyridine-3-carboxamide;1-(trifluoromethyl)cyclopropan-1-amine;6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]pyridin-2-amine has a molecular weight of 1214.13 g/mol, XLogP of 7.39, 14 rotatable bonds, 5 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(E)-dimethylaminomethylideneamino]-6-(dimethylaminomethylideneamino)pyridine-2-carboxamide;2-methoxypyridine-3-carboxylic acid;2-methoxy-N-[6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]-2-pyridinyl]pyridine-3-carboxamide;1-(trifluoromethyl)cyclopropan-1-amine;6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]pyridin-2-amine is sourced from PubChem (CID 172963785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).