N-[2-chloro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide

C85H83ClF2N12O12 — CID 167604795

About N-[2-chloro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide

N-[2-chloro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide (PubChem CID 167604795) has the molecular formula C85H83ClF2N12O12 and a molecular weight of 1538.12 g/mol. Its IUPAC name is N-[2-chloro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide.

Molecular Properties

• Compound Name: N-[2-chloro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide
• PubChem CID: 167604795
• Molecular Formula: C85H83ClF2N12O12
• Molecular Weight: 1538.12 g/mol
• Exact Mass: 1536.59
• IUPAC Name: N-[2-chloro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide
• SMILES: CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cc(C)no3)cn2)cc1Cl.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cc(C)no3)cn2)cc1F.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cc(C)no3)nc2)cc1C.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cc(C)no3)nc2)cc1F
• InChI: InChI=1S/C22H23N3O3.C21H20ClN3O3.2C21H20FN3O3/c1-5-22(27)25(4)20-9-7-16(10-14(20)2)17-6-8-19(23-13-17)21(26)12-18-11-15(3)24-28-18;2*1-4-21(27)25(3)19-8-6-14(10-17(19)22)18-7-5-15(12-23-18)20(26)11-16-9-13(2)24-28-16;1-4-21(27)25(3)19-8-6-14(10-17(19)22)15-5-7-18(23-12-15)20(26)11-16-9-13(2)24-28-16/h6-11,13H,5,12H2,1-4H3;3*5-10,12H,4,11H2,1-3H3
• InChIKey: KFSAGNRCMXDKTD-UHFFFAOYSA-N
• XLogP: 16.61
• TPSA: 305.20 Ų
• H-Bond Acceptors: 20
• Rotatable Bonds: 24
• Heavy Atoms: 112
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1538.12
LogP ≤ 5	16.61
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	20

Frequently Asked Questions

What is the IUPAC name of N-[2-chloro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide?

The IUPAC name of N-[2-chloro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide (CID 167604795) is N-[2-chloro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide.

What is the SMILES notation for N-[2-chloro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide?

The canonical SMILES for N-[2-chloro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide is CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cc(C)no3)cn2)cc1Cl.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cc(C)no3)cn2)cc1F.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cc(C)no3)nc2)cc1C.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cc(C)no3)nc2)cc1F.

What is the InChIKey of N-[2-chloro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide?

The InChIKey is KFSAGNRCMXDKTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O3.C21H20ClN3O3.2C21H20FN3O3/c1-5-22(27)25(4)20-9-7-16(10-14(20)2)17-6-8-19(23-13-17)21(26)12-18-11-15(3)24-28-18;2*1-4-21(27)25(3)19-8-6-14(10-17(19)22)18-7-5-15(12-23-18)20(26)11-16-9-13(2)24-28-16;1-4-21(27)25(3)19-8-6-14(10-17(19)22)15-5-7-18(23-12-15)20(26)11-16-9-13(2)24-28-16/h6-11,13H,5,12H2,1-4H3;3*5-10,12H,4,11H2,1-3H3.

What are the key properties of N-[2-chloro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide?

N-[2-chloro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide has a molecular weight of 1538.12 g/mol, XLogP of 16.61, 24 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-chloro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide is sourced from PubChem (CID 167604795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).