5-aminopyridine-2-carbonitrile;2-bromo-5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-bromopyridine-2-carbaldehyde;5-(5-bromo-2-pyridinyl)-1,3-oxazole;5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]-N'-hydroxypyridine-2-carboximidamide;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile

C76H62Br3N21O7 — CID 172941405

About 5-aminopyridine-2-carbonitrile;2-bromo-5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-bromopyridine-2-carbaldehyde;5-(5-bromo-2-pyridinyl)-1,3-oxazole;5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]-N'-hydroxypyridine-2-carboximidamide;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile

5-aminopyridine-2-carbonitrile;2-bromo-5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-bromopyridine-2-carbaldehyde;5-(5-bromo-2-pyridinyl)-1,3-oxazole;5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]-N'-hydroxypyridine-2-carboximidamide;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile (PubChem CID 172941405) has the molecular formula C76H62Br3N21O7 and a molecular weight of 1621.18 g/mol. Its IUPAC name is 5-aminopyridine-2-carbonitrile;2-bromo-5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-bromopyridine-2-carbaldehyde;5-(5-bromo-2-pyridinyl)-1,3-oxazole;5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]-N'-hydroxypyridine-2-carboximidamide;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile.

Molecular Properties

• Compound Name: 5-aminopyridine-2-carbonitrile;2-bromo-5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-bromopyridine-2-carbaldehyde;5-(5-bromo-2-pyridinyl)-1,3-oxazole;5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]-N'-hydroxypyridine-2-carboximidamide;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile
• PubChem CID: 172941405
• Molecular Formula: C76H62Br3N21O7
• Molecular Weight: 1621.18 g/mol
• Exact Mass: 1617.27
• IUPAC Name: 5-aminopyridine-2-carbonitrile;2-bromo-5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-bromopyridine-2-carbaldehyde;5-(5-bromo-2-pyridinyl)-1,3-oxazole;5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]-N'-hydroxypyridine-2-carboximidamide;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile
• SMILES: Brc1ccc(-c2cnco2)nc1.Brc1ncc(-c2ccc(C3CC3)cn2)o1.N#Cc1ccc(N)cn1.N#Cc1ccc(Nc2ncc(-c3ccc(C4CC4)cn3)o2)cn1.N/C(=N/O)c1ccc(Nc2ncc(-c3ccc(C4CC4)cn3)o2)cn1.O=Cc1ccc(Br)cn1.c1ncc(-c2ccc(C3CC3)cn2)o1
• InChI: InChI=1S/C17H16N6O2.C17H13N5O.C11H9BrN2O.C11H10N2O.C8H5BrN2O.C6H4BrNO.C6H5N3/c18-16(23-24)14-6-4-12(8-20-14)22-17-21-9-15(25-17)13-5-3-11(7-19-13)10-1-2-10;18-7-13-4-5-14(9-19-13)22-17-21-10-16(23-17)15-6-3-12(8-20-15)11-1-2-11;12-11-14-6-10(15-11)9-4-3-8(5-13-9)7-1-2-7;1-2-8(1)9-3-4-10(13-5-9)11-6-12-7-14-11;9-6-1-2-7(11-3-6)8-4-10-5-12-8;7-5-1-2-6(4-9)8-3-5;7-3-6-2-1-5(8)4-9-6/h3-10,24H,1-2H2,(H2,18,23)(H,21,22);3-6,8-11H,1-2H2,(H,21,22);3-7H,1-2H2;3-8H,1-2H2;1-5H;1-4H;1-2,4H,8H2
• InChIKey: BUZHIWWYCBOYCE-UHFFFAOYSA-N
• XLogP: 17.15
• TPSA: 419.50 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 27
• Rotatable Bonds: 15
• Heavy Atoms: 107
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1621.18
LogP ≤ 5	17.15
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	27

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-aminopyridine-2-carbonitrile;2-bromo-5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-bromopyridine-2-carbaldehyde;5-(5-bromo-2-pyridinyl)-1,3-oxazole;5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]-N'-hydroxypyridine-2-carboximidamide;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile?

The IUPAC name of 5-aminopyridine-2-carbonitrile;2-bromo-5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-bromopyridine-2-carbaldehyde;5-(5-bromo-2-pyridinyl)-1,3-oxazole;5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]-N'-hydroxypyridine-2-carboximidamide;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile (CID 172941405) is 5-aminopyridine-2-carbonitrile;2-bromo-5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-bromopyridine-2-carbaldehyde;5-(5-bromo-2-pyridinyl)-1,3-oxazole;5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]-N'-hydroxypyridine-2-carboximidamide;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile.

What is the SMILES notation for 5-aminopyridine-2-carbonitrile;2-bromo-5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-bromopyridine-2-carbaldehyde;5-(5-bromo-2-pyridinyl)-1,3-oxazole;5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]-N'-hydroxypyridine-2-carboximidamide;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile?

The canonical SMILES for 5-aminopyridine-2-carbonitrile;2-bromo-5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-bromopyridine-2-carbaldehyde;5-(5-bromo-2-pyridinyl)-1,3-oxazole;5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]-N'-hydroxypyridine-2-carboximidamide;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile is Brc1ccc(-c2cnco2)nc1.Brc1ncc(-c2ccc(C3CC3)cn2)o1.N#Cc1ccc(N)cn1.N#Cc1ccc(Nc2ncc(-c3ccc(C4CC4)cn3)o2)cn1.N/C(=N/O)c1ccc(Nc2ncc(-c3ccc(C4CC4)cn3)o2)cn1.O=Cc1ccc(Br)cn1.c1ncc(-c2ccc(C3CC3)cn2)o1.

What is the InChIKey of 5-aminopyridine-2-carbonitrile;2-bromo-5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-bromopyridine-2-carbaldehyde;5-(5-bromo-2-pyridinyl)-1,3-oxazole;5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]-N'-hydroxypyridine-2-carboximidamide;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile?

The InChIKey is BUZHIWWYCBOYCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N6O2.C17H13N5O.C11H9BrN2O.C11H10N2O.C8H5BrN2O.C6H4BrNO.C6H5N3/c18-16(23-24)14-6-4-12(8-20-14)22-17-21-9-15(25-17)13-5-3-11(7-19-13)10-1-2-10;18-7-13-4-5-14(9-19-13)22-17-21-10-16(23-17)15-6-3-12(8-20-15)11-1-2-11;12-11-14-6-10(15-11)9-4-3-8(5-13-9)7-1-2-7;1-2-8(1)9-3-4-10(13-5-9)11-6-12-7-14-11;9-6-1-2-7(11-3-6)8-4-10-5-12-8;7-5-1-2-6(4-9)8-3-5;7-3-6-2-1-5(8)4-9-6/h3-10,24H,1-2H2,(H2,18,23)(H,21,22);3-6,8-11H,1-2H2,(H,21,22);3-7H,1-2H2;3-8H,1-2H2;1-5H;1-4H;1-2,4H,8H2.

What are the key properties of 5-aminopyridine-2-carbonitrile;2-bromo-5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-bromopyridine-2-carbaldehyde;5-(5-bromo-2-pyridinyl)-1,3-oxazole;5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]-N'-hydroxypyridine-2-carboximidamide;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile?

5-aminopyridine-2-carbonitrile;2-bromo-5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-bromopyridine-2-carbaldehyde;5-(5-bromo-2-pyridinyl)-1,3-oxazole;5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]-N'-hydroxypyridine-2-carboximidamide;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile has a molecular weight of 1621.18 g/mol, XLogP of 17.15, 15 rotatable bonds, 5 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 5-aminopyridine-2-carbonitrile;2-bromo-5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-bromopyridine-2-carbaldehyde;5-(5-bromo-2-pyridinyl)-1,3-oxazole;5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazole;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]-N'-hydroxypyridine-2-carboximidamide;5-[[5-(5-cyclopropyl-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile is sourced from PubChem (CID 172941405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).