6-bromo-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-methyl-3-morpholin-4-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;N-(1-methyl-3-piperidin-1-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;6-(5-methyl-1H-pyrazol-4-yl)-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide

C97H98BrN31O6 — CID 157315674

IUPAC6-bromo-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-methyl-3-morpholin-4-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;N-(1-methyl-3-piperidin-1-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;6-(5-methyl-1H-pyrazol-4-yl)-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide
SMILESCC(C)n1cc(NC(=O)c2cccc(-c3cn[nH]c3)n2)c(-c2ccccn2)n1.CC(C)n1cc(NC(=O)c2cccc(Br)n2)c(-c2ccccn2)n1.Cc1[nH]ncc1-c1cccc(C(=O)Nc2cn(C)nc2-c2ccccn2)n1.Cc1cncc(-c2cccc(C(=O)Nc3cn(C)nc3N3CCCCC3)n2)c1.Cc1cncc(-c2cccc(C(=O)Nc3cn(C)nc3N3CCOCC3)n2)c1
InChIInChI=1S/C21H24N6O.C20H19N7O.C20H22N6O2.C19H17N7O.C17H16BrN5O/c1-15-11-16(13-22-12-15)17-7-6-8-18(23-17)21(28)24-19-14-26(2)25-20(19)27-9-4-3-5-10-27;1-13(2)27-12-18(19(26-27)16-6-3-4-9-21-16)25-20(28)17-8-5-7-15(24-17)14-10-22-23-11-14;1-14-10-15(12-21-11-14)16-4-3-5-17(22-16)20(27)23-18-13-25(2)24-19(18)26-6-8-28-9-7-26;1-12-13(10-21-24-12)14-7-5-8-16(22-14)19(27)23-17-11-26(2)25-18(17)15-6-3-4-9-20-15;1-11(2)23-10-14(16(22-23)12-6-3-4-9-19-12)21-17(24)13-7-5-8-15(18)20-13/h6-8,11-14H,3-5,9-10H2,1-2H3,(H,24,28);3-13H,1-2H3,(H,22,23)(H,25,28);3-5,10-13H,6-9H2,1-2H3,(H,23,27);3-11H,1-2H3,(H,21,24)(H,23,27);3-11H,1-2H3,(H,21,24)
InChIKeyBDOGKHYRRHILGX-UHFFFAOYSA-N
MW1873.97 g/mol
LogP16.03
Rot. Bonds21

About 6-bromo-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-methyl-3-morpholin-4-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;N-(1-methyl-3-piperidin-1-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;6-(5-methyl-1H-pyrazol-4-yl)-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide

6-bromo-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-methyl-3-morpholin-4-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;N-(1-methyl-3-piperidin-1-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;6-(5-methyl-1H-pyrazol-4-yl)-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide (PubChem CID 157315674) has the molecular formula C97H98BrN31O6 and a molecular weight of 1873.97 g/mol. Its IUPAC name is 6-bromo-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-methyl-3-morpholin-4-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;N-(1-methyl-3-piperidin-1-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;6-(5-methyl-1H-pyrazol-4-yl)-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-bromo-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-methyl-3-morpholin-4-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;N-(1-methyl-3-piperidin-1-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;6-(5-methyl-1H-pyrazol-4-yl)-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide
PubChem CID157315674
Molecular FormulaC97H98BrN31O6
Molecular Weight1873.97 g/mol
Exact Mass1871.75
IUPAC Name6-bromo-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-methyl-3-morpholin-4-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;N-(1-methyl-3-piperidin-1-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;6-(5-methyl-1H-pyrazol-4-yl)-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide
SMILESCC(C)n1cc(NC(=O)c2cccc(-c3cn[nH]c3)n2)c(-c2ccccn2)n1.CC(C)n1cc(NC(=O)c2cccc(Br)n2)c(-c2ccccn2)n1.Cc1[nH]ncc1-c1cccc(C(=O)Nc2cn(C)nc2-c2ccccn2)n1.Cc1cncc(-c2cccc(C(=O)Nc3cn(C)nc3N3CCCCC3)n2)c1.Cc1cncc(-c2cccc(C(=O)Nc3cn(C)nc3N3CCOCC3)n2)c1
InChIInChI=1S/C21H24N6O.C20H19N7O.C20H22N6O2.C19H17N7O.C17H16BrN5O/c1-15-11-16(13-22-12-15)17-7-6-8-18(23-17)21(28)24-19-14-26(2)25-20(19)27-9-4-3-5-10-27;1-13(2)27-12-18(19(26-27)16-6-3-4-9-21-16)25-20(28)17-8-5-7-15(24-17)14-10-22-23-11-14;1-14-10-15(12-21-11-14)16-4-3-5-17(22-16)20(27)23-18-13-25(2)24-19(18)26-6-8-28-9-7-26;1-12-13(10-21-24-12)14-7-5-8-16(22-14)19(27)23-17-11-26(2)25-18(17)15-6-3-4-9-20-15;1-11(2)23-10-14(16(22-23)12-6-3-4-9-19-12)21-17(24)13-7-5-8-15(18)20-13/h6-8,11-14H,3-5,9-10H2,1-2H3,(H,24,28);3-13H,1-2H3,(H,22,23)(H,25,28);3-5,10-13H,6-9H2,1-2H3,(H,23,27);3-11H,1-2H3,(H,21,24)(H,23,27);3-11H,1-2H3,(H,21,24)
InChIKeyBDOGKHYRRHILGX-UHFFFAOYSA-N
XLogP16.03
TPSA436.57 Ų
H-Bond Donors7
H-Bond Acceptors30
Rotatable Bonds21
Heavy Atoms135
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001873.97
LogP ≤ 516.03
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1030

Computed Properties (RDKit)

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

Analyze 6-bromo-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-methyl-3-morpholin-4-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;N-(1-methyl-3-piperidin-1-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;6-(5-methyl-1H-pyrazol-4-yl)-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-methyl-3-morpholin-4-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;N-(1-methyl-3-piperidin-1-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;6-(5-methyl-1H-pyrazol-4-yl)-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide?
The IUPAC name of 6-bromo-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-methyl-3-morpholin-4-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;N-(1-methyl-3-piperidin-1-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;6-(5-methyl-1H-pyrazol-4-yl)-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide (CID 157315674) is 6-bromo-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-methyl-3-morpholin-4-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;N-(1-methyl-3-piperidin-1-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;6-(5-methyl-1H-pyrazol-4-yl)-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide.
What is the SMILES notation for 6-bromo-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-methyl-3-morpholin-4-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;N-(1-methyl-3-piperidin-1-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;6-(5-methyl-1H-pyrazol-4-yl)-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide?
The canonical SMILES for 6-bromo-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-methyl-3-morpholin-4-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;N-(1-methyl-3-piperidin-1-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;6-(5-methyl-1H-pyrazol-4-yl)-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide is CC(C)n1cc(NC(=O)c2cccc(-c3cn[nH]c3)n2)c(-c2ccccn2)n1.CC(C)n1cc(NC(=O)c2cccc(Br)n2)c(-c2ccccn2)n1.Cc1[nH]ncc1-c1cccc(C(=O)Nc2cn(C)nc2-c2ccccn2)n1.Cc1cncc(-c2cccc(C(=O)Nc3cn(C)nc3N3CCCCC3)n2)c1.Cc1cncc(-c2cccc(C(=O)Nc3cn(C)nc3N3CCOCC3)n2)c1.
What is the InChIKey of 6-bromo-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-methyl-3-morpholin-4-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;N-(1-methyl-3-piperidin-1-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;6-(5-methyl-1H-pyrazol-4-yl)-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide?
The InChIKey is BDOGKHYRRHILGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N6O.C20H19N7O.C20H22N6O2.C19H17N7O.C17H16BrN5O/c1-15-11-16(13-22-12-15)17-7-6-8-18(23-17)21(28)24-19-14-26(2)25-20(19)27-9-4-3-5-10-27;1-13(2)27-12-18(19(26-27)16-6-3-4-9-21-16)25-20(28)17-8-5-7-15(24-17)14-10-22-23-11-14;1-14-10-15(12-21-11-14)16-4-3-5-17(22-16)20(27)23-18-13-25(2)24-19(18)26-6-8-28-9-7-26;1-12-13(10-21-24-12)14-7-5-8-16(22-14)19(27)23-17-11-26(2)25-18(17)15-6-3-4-9-20-15;1-11(2)23-10-14(16(22-23)12-6-3-4-9-19-12)21-17(24)13-7-5-8-15(18)20-13/h6-8,11-14H,3-5,9-10H2,1-2H3,(H,24,28);3-13H,1-2H3,(H,22,23)(H,25,28);3-5,10-13H,6-9H2,1-2H3,(H,23,27);3-11H,1-2H3,(H,21,24)(H,23,27);3-11H,1-2H3,(H,21,24).
What are the key properties of 6-bromo-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-methyl-3-morpholin-4-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;N-(1-methyl-3-piperidin-1-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;6-(5-methyl-1H-pyrazol-4-yl)-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide?
6-bromo-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-methyl-3-morpholin-4-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;N-(1-methyl-3-piperidin-1-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;6-(5-methyl-1H-pyrazol-4-yl)-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide has a molecular weight of 1873.97 g/mol, XLogP of 16.03, 21 rotatable bonds, 7 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-methyl-3-morpholin-4-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;N-(1-methyl-3-piperidin-1-ylpyrazol-4-yl)-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;6-(5-methyl-1H-pyrazol-4-yl)-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-4-yl)-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide is sourced from PubChem (CID 157315674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).