(2R)-N-[4-methyl-2-[(2-methyl-7-oxo-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl]-2-phenoxypropanamide

C24H23N3O5 — CID 51692788

About (2R)-N-[4-methyl-2-[(2-methyl-7-oxo-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl]-2-phenoxypropanamide

(2R)-N-[4-methyl-2-[(2-methyl-7-oxo-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl]-2-phenoxypropanamide (PubChem CID 51692788) has the molecular formula C24H23N3O5 and a molecular weight of 433.46 g/mol. Its IUPAC name is (2R)-N-[4-methyl-2-[(2-methyl-7-oxo-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl]-2-phenoxypropanamide.

Molecular Properties

• Compound Name: (2R)-N-[4-methyl-2-[(2-methyl-7-oxo-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl]-2-phenoxypropanamide
• PubChem CID: 51692788
• Molecular Formula: C24H23N3O5
• Molecular Weight: 433.46 g/mol
• Exact Mass: 433.16
• IUPAC Name: (2R)-N-[4-methyl-2-[(2-methyl-7-oxo-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl]-2-phenoxypropanamide
• SMILES: Cc1ccc(NC(=O)[C@@H](C)Oc2ccccc2)c(OCc2cc(=O)n3oc(C)cc3n2)c1
• InChI: InChI=1S/C24H23N3O5/c1-15-9-10-20(26-24(29)17(3)31-19-7-5-4-6-8-19)21(11-15)30-14-18-13-23(28)27-22(25-18)12-16(2)32-27/h4-13,17H,14H2,1-3H3,(H,26,29)/t17-/m1/s1
• InChIKey: AMCMNCVCCSXVQG-QGZVFWFLSA-N
• XLogP: 3.89
• TPSA: 95.07 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 7
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	433.46
LogP ≤ 5	3.89
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[4-methyl-2-[(2-methyl-7-oxo-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl]-2-phenoxypropanamide?

The IUPAC name of (2R)-N-[4-methyl-2-[(2-methyl-7-oxo-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl]-2-phenoxypropanamide (CID 51692788) is (2R)-N-[4-methyl-2-[(2-methyl-7-oxo-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl]-2-phenoxypropanamide.

What is the SMILES notation for (2R)-N-[4-methyl-2-[(2-methyl-7-oxo-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl]-2-phenoxypropanamide?

The canonical SMILES for (2R)-N-[4-methyl-2-[(2-methyl-7-oxo-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl]-2-phenoxypropanamide is Cc1ccc(NC(=O)[C@@H](C)Oc2ccccc2)c(OCc2cc(=O)n3oc(C)cc3n2)c1.

What is the InChIKey of (2R)-N-[4-methyl-2-[(2-methyl-7-oxo-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl]-2-phenoxypropanamide?

The InChIKey is AMCMNCVCCSXVQG-QGZVFWFLSA-N. The full InChI is InChI=1S/C24H23N3O5/c1-15-9-10-20(26-24(29)17(3)31-19-7-5-4-6-8-19)21(11-15)30-14-18-13-23(28)27-22(25-18)12-16(2)32-27/h4-13,17H,14H2,1-3H3,(H,26,29)/t17-/m1/s1.

What are the key properties of (2R)-N-[4-methyl-2-[(2-methyl-7-oxo-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl]-2-phenoxypropanamide?

(2R)-N-[4-methyl-2-[(2-methyl-7-oxo-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl]-2-phenoxypropanamide has a molecular weight of 433.46 g/mol, XLogP of 3.89, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for (2R)-N-[4-methyl-2-[(2-methyl-7-oxo-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl]-2-phenoxypropanamide is sourced from PubChem (CID 51692788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).