2-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-4-carboxamide;5-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-3-carboxamide;6-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-2-carboxamide;methane;N-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-ylamino)benzamide;N-methyl-3-[[6-(trifluoromethyl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]amino]benzamide

C72H57Cl6F3N20O10 — CID 160810681

About 2-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-4-carboxamide;5-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-3-carboxamide;6-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-2-carboxamide;methane;N-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-ylamino)benzamide;N-methyl-3-[[6-(trifluoromethyl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]amino]benzamide

2-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-4-carboxamide;5-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-3-carboxamide;6-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-2-carboxamide;methane;N-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-ylamino)benzamide;N-methyl-3-[[6-(trifluoromethyl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]amino]benzamide (PubChem CID 160810681) has the molecular formula C72H57Cl6F3N20O10 and a molecular weight of 1632.09 g/mol. Its IUPAC name is 2-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-4-carboxamide;5-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-3-carboxamide;6-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-2-carboxamide;methane;N-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-ylamino)benzamide;N-methyl-3-[[6-(trifluoromethyl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]amino]benzamide.

Molecular Properties

• Compound Name: 2-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-4-carboxamide;5-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-3-carboxamide;6-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-2-carboxamide;methane;N-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-ylamino)benzamide;N-methyl-3-[[6-(trifluoromethyl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]amino]benzamide
• PubChem CID: 160810681
• Molecular Formula: C72H57Cl6F3N20O10
• Molecular Weight: 1632.09 g/mol
• Exact Mass: 1628.26
• IUPAC Name: 2-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-4-carboxamide;5-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-3-carboxamide;6-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-2-carboxamide;methane;N-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-ylamino)benzamide;N-methyl-3-[[6-(trifluoromethyl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]amino]benzamide
• SMILES: C.CNC(=O)c1cccc(Nc2nc3cc(Cl)c(Cl)cc3o2)n1.CNC(=O)c1cccc(Nc2nc3ncc(C(F)(F)F)cc3o2)c1.CNC(=O)c1cccc(Nc2nc3ncccc3o2)c1.CNC(=O)c1ccnc(Nc2nc3cc(Cl)c(Cl)cc3o2)c1.CNC(=O)c1cncc(Nc2nc3cc(Cl)c(Cl)cc3o2)c1
• InChI: InChI=1S/C15H11F3N4O2.3C14H10Cl2N4O2.C14H12N4O2.CH4/c1-19-13(23)8-3-2-4-10(5-8)21-14-22-12-11(24-14)6-9(7-20-12)15(16,17)18;1-17-13(21)7-2-8(6-18-5-7)19-14-20-11-3-9(15)10(16)4-12(11)22-14;1-17-13(21)7-2-3-18-12(4-7)20-14-19-10-5-8(15)9(16)6-11(10)22-14;1-17-13(21)9-3-2-4-12(18-9)20-14-19-10-5-7(15)8(16)6-11(10)22-14;1-15-13(19)9-4-2-5-10(8-9)17-14-18-12-11(20-14)6-3-7-16-12;/h2-7H,1H3,(H,19,23)(H,20,21,22);2-6H,1H3,(H,17,21)(H,19,20);2*2-6H,1H3,(H,17,21)(H,18,19,20);2-8H,1H3,(H,15,19)(H,16,17,18);1H4
• InChIKey: SEGVQVZIDGPCDP-UHFFFAOYSA-N
• XLogP: 17.21
• TPSA: 400.25 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 25
• Rotatable Bonds: 15
• Heavy Atoms: 111
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1632.09
LogP ≤ 5	17.21
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	25

Frequently Asked Questions

What is the IUPAC name of 2-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-4-carboxamide;5-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-3-carboxamide;6-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-2-carboxamide;methane;N-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-ylamino)benzamide;N-methyl-3-[[6-(trifluoromethyl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]amino]benzamide?

The IUPAC name of 2-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-4-carboxamide;5-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-3-carboxamide;6-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-2-carboxamide;methane;N-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-ylamino)benzamide;N-methyl-3-[[6-(trifluoromethyl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]amino]benzamide (CID 160810681) is 2-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-4-carboxamide;5-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-3-carboxamide;6-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-2-carboxamide;methane;N-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-ylamino)benzamide;N-methyl-3-[[6-(trifluoromethyl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]amino]benzamide.

What is the SMILES notation for 2-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-4-carboxamide;5-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-3-carboxamide;6-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-2-carboxamide;methane;N-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-ylamino)benzamide;N-methyl-3-[[6-(trifluoromethyl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]amino]benzamide?

The canonical SMILES for 2-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-4-carboxamide;5-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-3-carboxamide;6-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-2-carboxamide;methane;N-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-ylamino)benzamide;N-methyl-3-[[6-(trifluoromethyl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]amino]benzamide is C.CNC(=O)c1cccc(Nc2nc3cc(Cl)c(Cl)cc3o2)n1.CNC(=O)c1cccc(Nc2nc3ncc(C(F)(F)F)cc3o2)c1.CNC(=O)c1cccc(Nc2nc3ncccc3o2)c1.CNC(=O)c1ccnc(Nc2nc3cc(Cl)c(Cl)cc3o2)c1.CNC(=O)c1cncc(Nc2nc3cc(Cl)c(Cl)cc3o2)c1.

What is the InChIKey of 2-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-4-carboxamide;5-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-3-carboxamide;6-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-2-carboxamide;methane;N-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-ylamino)benzamide;N-methyl-3-[[6-(trifluoromethyl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]amino]benzamide?

The InChIKey is SEGVQVZIDGPCDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11F3N4O2.3C14H10Cl2N4O2.C14H12N4O2.CH4/c1-19-13(23)8-3-2-4-10(5-8)21-14-22-12-11(24-14)6-9(7-20-12)15(16,17)18;1-17-13(21)7-2-8(6-18-5-7)19-14-20-11-3-9(15)10(16)4-12(11)22-14;1-17-13(21)7-2-3-18-12(4-7)20-14-19-10-5-8(15)9(16)6-11(10)22-14;1-17-13(21)9-3-2-4-12(18-9)20-14-19-10-5-7(15)8(16)6-11(10)22-14;1-15-13(19)9-4-2-5-10(8-9)17-14-18-12-11(20-14)6-3-7-16-12;/h2-7H,1H3,(H,19,23)(H,20,21,22);2-6H,1H3,(H,17,21)(H,19,20);2*2-6H,1H3,(H,17,21)(H,18,19,20);2-8H,1H3,(H,15,19)(H,16,17,18);1H4.

What are the key properties of 2-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-4-carboxamide;5-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-3-carboxamide;6-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-2-carboxamide;methane;N-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-ylamino)benzamide;N-methyl-3-[[6-(trifluoromethyl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]amino]benzamide?

2-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-4-carboxamide;5-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-3-carboxamide;6-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-2-carboxamide;methane;N-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-ylamino)benzamide;N-methyl-3-[[6-(trifluoromethyl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]amino]benzamide has a molecular weight of 1632.09 g/mol, XLogP of 17.21, 15 rotatable bonds, 10 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-4-carboxamide;5-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-3-carboxamide;6-[(5,6-dichloro-1,3-benzoxazol-2-yl)amino]-N-methylpyridine-2-carboxamide;methane;N-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-ylamino)benzamide;N-methyl-3-[[6-(trifluoromethyl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]amino]benzamide is sourced from PubChem (CID 160810681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).