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

C81H75ClF2N12O12 — CID 167601042

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

N-[2-chloro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]propanamide (PubChem CID 167601042) has the molecular formula C81H75ClF2N12O12 and a molecular weight of 1482.01 g/mol. Its IUPAC name is N-[2-chloro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]propanamide.

Molecular Properties

• Compound Name: N-[2-chloro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]propanamide
• PubChem CID: 167601042
• Molecular Formula: C81H75ClF2N12O12
• Molecular Weight: 1482.01 g/mol
• Exact Mass: 1480.53
• IUPAC Name: N-[2-chloro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]propanamide
• SMILES: CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3ncco3)cn2)cc1Cl.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3ncco3)cn2)cc1F.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3ncco3)nc2)cc1C.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3ncco3)nc2)cc1F
• InChI: InChI=1S/C21H21N3O3.C20H18ClN3O3.2C20H18FN3O3/c1-4-21(26)24(3)18-8-6-15(11-14(18)2)16-5-7-17(23-13-16)19(25)12-20-22-9-10-27-20;2*1-3-20(26)24(2)17-7-5-13(10-15(17)21)16-6-4-14(12-23-16)18(25)11-19-22-8-9-27-19;1-3-20(26)24(2)17-7-5-13(10-15(17)21)14-4-6-16(23-12-14)18(25)11-19-22-8-9-27-19/h5-11,13H,4,12H2,1-3H3;3*4-10,12H,3,11H2,1-2H3
• InChIKey: JSXKJBAQTXTXDU-UHFFFAOYSA-N
• XLogP: 15.38
• TPSA: 305.20 Ų
• H-Bond Acceptors: 20
• Rotatable Bonds: 24
• Heavy Atoms: 108
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1482.01
LogP ≤ 5	15.38
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-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]propanamide?

The IUPAC name of N-[2-chloro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]propanamide (CID 167601042) is N-[2-chloro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]propanamide.

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

The canonical SMILES for N-[2-chloro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]propanamide is CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3ncco3)cn2)cc1Cl.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3ncco3)cn2)cc1F.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3ncco3)nc2)cc1C.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3ncco3)nc2)cc1F.

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

The InChIKey is JSXKJBAQTXTXDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O3.C20H18ClN3O3.2C20H18FN3O3/c1-4-21(26)24(3)18-8-6-15(11-14(18)2)16-5-7-17(23-13-16)19(25)12-20-22-9-10-27-20;2*1-3-20(26)24(2)17-7-5-13(10-15(17)21)16-6-4-14(12-23-16)18(25)11-19-22-8-9-27-19;1-3-20(26)24(2)17-7-5-13(10-15(17)21)14-4-6-16(23-12-14)18(25)11-19-22-8-9-27-19/h5-11,13H,4,12H2,1-3H3;3*4-10,12H,3,11H2,1-2H3.

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

N-[2-chloro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]propanamide has a molecular weight of 1482.01 g/mol, XLogP of 15.38, 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-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]propanamide is sourced from PubChem (CID 167601042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).