N-[[(5S)-3-[3-fluoro-4-[3-[(1,2-oxazol-3-ylamino)methyl]imidazo[1,2-a]pyridin-7-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide

C23H21FN6O4 — CID 58239244

About N-[[(5S)-3-[3-fluoro-4-[3-[(1,2-oxazol-3-ylamino)methyl]imidazo[1,2-a]pyridin-7-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide

N-[[(5S)-3-[3-fluoro-4-[3-[(1,2-oxazol-3-ylamino)methyl]imidazo[1,2-a]pyridin-7-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide (PubChem CID 58239244) has the molecular formula C23H21FN6O4 and a molecular weight of 464.46 g/mol. Its IUPAC name is N-[[(5S)-3-[3-fluoro-4-[3-[(1,2-oxazol-3-ylamino)methyl]imidazo[1,2-a]pyridin-7-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide.

Molecular Properties

• Compound Name: N-[[(5S)-3-[3-fluoro-4-[3-[(1,2-oxazol-3-ylamino)methyl]imidazo[1,2-a]pyridin-7-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
• PubChem CID: 58239244
• Molecular Formula: C23H21FN6O4
• Molecular Weight: 464.46 g/mol
• Exact Mass: 464.16
• IUPAC Name: N-[[(5S)-3-[3-fluoro-4-[3-[(1,2-oxazol-3-ylamino)methyl]imidazo[1,2-a]pyridin-7-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
• SMILES: CC(=O)NC[C@H]1CN(c2ccc(-c3ccn4c(CNc5ccon5)cnc4c3)c(F)c2)C(=O)O1
• InChI: InChI=1S/C23H21FN6O4/c1-14(31)25-12-18-13-30(23(32)34-18)16-2-3-19(20(24)9-16)15-4-6-29-17(11-27-22(29)8-15)10-26-21-5-7-33-28-21/h2-9,11,18H,10,12-13H2,1H3,(H,25,31)(H,26,28)/t18-/m0/s1
• InChIKey: WTKZYMXIQXYVOU-SFHVURJKSA-N
• XLogP: 3.20
• TPSA: 114.00 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 8
• Rotatable Bonds: 7
• Heavy Atoms: 34
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	464.46
LogP ≤ 5	3.20
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of N-[[(5S)-3-[3-fluoro-4-[3-[(1,2-oxazol-3-ylamino)methyl]imidazo[1,2-a]pyridin-7-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide?

The IUPAC name of N-[[(5S)-3-[3-fluoro-4-[3-[(1,2-oxazol-3-ylamino)methyl]imidazo[1,2-a]pyridin-7-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide (CID 58239244) is N-[[(5S)-3-[3-fluoro-4-[3-[(1,2-oxazol-3-ylamino)methyl]imidazo[1,2-a]pyridin-7-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide.

What is the SMILES notation for N-[[(5S)-3-[3-fluoro-4-[3-[(1,2-oxazol-3-ylamino)methyl]imidazo[1,2-a]pyridin-7-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide?

The canonical SMILES for N-[[(5S)-3-[3-fluoro-4-[3-[(1,2-oxazol-3-ylamino)methyl]imidazo[1,2-a]pyridin-7-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide is CC(=O)NC[C@H]1CN(c2ccc(-c3ccn4c(CNc5ccon5)cnc4c3)c(F)c2)C(=O)O1.

What is the InChIKey of N-[[(5S)-3-[3-fluoro-4-[3-[(1,2-oxazol-3-ylamino)methyl]imidazo[1,2-a]pyridin-7-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide?

The InChIKey is WTKZYMXIQXYVOU-SFHVURJKSA-N. The full InChI is InChI=1S/C23H21FN6O4/c1-14(31)25-12-18-13-30(23(32)34-18)16-2-3-19(20(24)9-16)15-4-6-29-17(11-27-22(29)8-15)10-26-21-5-7-33-28-21/h2-9,11,18H,10,12-13H2,1H3,(H,25,31)(H,26,28)/t18-/m0/s1.

What are the key properties of N-[[(5S)-3-[3-fluoro-4-[3-[(1,2-oxazol-3-ylamino)methyl]imidazo[1,2-a]pyridin-7-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide?

N-[[(5S)-3-[3-fluoro-4-[3-[(1,2-oxazol-3-ylamino)methyl]imidazo[1,2-a]pyridin-7-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide has a molecular weight of 464.46 g/mol, XLogP of 3.20, 7 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for N-[[(5S)-3-[3-fluoro-4-[3-[(1,2-oxazol-3-ylamino)methyl]imidazo[1,2-a]pyridin-7-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide is sourced from PubChem (CID 58239244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).