N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-[5-[4-(2-methylpropyl)phenyl]-1,3-oxazol-2-yl]propanamide

C27H35N3O4 — CID 24643854

About N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-[5-[4-(2-methylpropyl)phenyl]-1,3-oxazol-2-yl]propanamide

N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-[5-[4-(2-methylpropyl)phenyl]-1,3-oxazol-2-yl]propanamide (PubChem CID 24643854) has the molecular formula C27H35N3O4 and a molecular weight of 465.59 g/mol. Its IUPAC name is N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-[5-[4-(2-methylpropyl)phenyl]-1,3-oxazol-2-yl]propanamide.

Molecular Properties

• Compound Name: N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-[5-[4-(2-methylpropyl)phenyl]-1,3-oxazol-2-yl]propanamide
• PubChem CID: 24643854
• Molecular Formula: C27H35N3O4
• Molecular Weight: 465.59 g/mol
• Exact Mass: 465.26
• IUPAC Name: N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-[5-[4-(2-methylpropyl)phenyl]-1,3-oxazol-2-yl]propanamide
• SMILES: Cc1ccc(C(CNC(=O)CCc2ncc(-c3ccc(CC(C)C)cc3)o2)N2CCOCC2)o1
• InChI: InChI=1S/C27H35N3O4/c1-19(2)16-21-5-7-22(8-6-21)25-18-29-27(34-25)11-10-26(31)28-17-23(24-9-4-20(3)33-24)30-12-14-32-15-13-30/h4-9,18-19,23H,10-17H2,1-3H3,(H,28,31)
• InChIKey: FRLIPQDIGVWBJK-UHFFFAOYSA-N
• XLogP: 4.56
• TPSA: 80.74 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 10
• Heavy Atoms: 34
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	465.59
LogP ≤ 5	4.56
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-[5-[4-(2-methylpropyl)phenyl]-1,3-oxazol-2-yl]propanamide?

The IUPAC name of N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-[5-[4-(2-methylpropyl)phenyl]-1,3-oxazol-2-yl]propanamide (CID 24643854) is N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-[5-[4-(2-methylpropyl)phenyl]-1,3-oxazol-2-yl]propanamide.

What is the SMILES notation for N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-[5-[4-(2-methylpropyl)phenyl]-1,3-oxazol-2-yl]propanamide?

The canonical SMILES for N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-[5-[4-(2-methylpropyl)phenyl]-1,3-oxazol-2-yl]propanamide is Cc1ccc(C(CNC(=O)CCc2ncc(-c3ccc(CC(C)C)cc3)o2)N2CCOCC2)o1.

What is the InChIKey of N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-[5-[4-(2-methylpropyl)phenyl]-1,3-oxazol-2-yl]propanamide?

The InChIKey is FRLIPQDIGVWBJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H35N3O4/c1-19(2)16-21-5-7-22(8-6-21)25-18-29-27(34-25)11-10-26(31)28-17-23(24-9-4-20(3)33-24)30-12-14-32-15-13-30/h4-9,18-19,23H,10-17H2,1-3H3,(H,28,31).

What are the key properties of N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-[5-[4-(2-methylpropyl)phenyl]-1,3-oxazol-2-yl]propanamide?

N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-[5-[4-(2-methylpropyl)phenyl]-1,3-oxazol-2-yl]propanamide has a molecular weight of 465.59 g/mol, XLogP of 4.56, 10 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-[5-[4-(2-methylpropyl)phenyl]-1,3-oxazol-2-yl]propanamide is sourced from PubChem (CID 24643854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).