(5-phenoxy-2,3-dihydro-1H-inden-2-yl)-(5-pyridin-2-yl-1,3-oxazol-2-yl)methanone

C24H18N2O3 — CID 54583373

About (5-phenoxy-2,3-dihydro-1H-inden-2-yl)-(5-pyridin-2-yl-1,3-oxazol-2-yl)methanone

(5-phenoxy-2,3-dihydro-1H-inden-2-yl)-(5-pyridin-2-yl-1,3-oxazol-2-yl)methanone (PubChem CID 54583373) has the molecular formula C24H18N2O3 and a molecular weight of 382.42 g/mol. Its IUPAC name is (5-phenoxy-2,3-dihydro-1H-inden-2-yl)-(5-pyridin-2-yl-1,3-oxazol-2-yl)methanone.

Molecular Properties

• Compound Name: (5-phenoxy-2,3-dihydro-1H-inden-2-yl)-(5-pyridin-2-yl-1,3-oxazol-2-yl)methanone
• PubChem CID: 54583373
• Molecular Formula: C24H18N2O3
• Molecular Weight: 382.42 g/mol
• Exact Mass: 382.13
• IUPAC Name: (5-phenoxy-2,3-dihydro-1H-inden-2-yl)-(5-pyridin-2-yl-1,3-oxazol-2-yl)methanone
• SMILES: O=C(c1ncc(-c2ccccn2)o1)C1Cc2ccc(Oc3ccccc3)cc2C1
• InChI: InChI=1S/C24H18N2O3/c27-23(24-26-15-22(29-24)21-8-4-5-11-25-21)18-12-16-9-10-20(14-17(16)13-18)28-19-6-2-1-3-7-19/h1-11,14-15,18H,12-13H2
• InChIKey: RLFWFFNASDWVLA-UHFFFAOYSA-N
• XLogP: 5.13
• TPSA: 65.22 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	382.42
LogP ≤ 5	5.13
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of (5-phenoxy-2,3-dihydro-1H-inden-2-yl)-(5-pyridin-2-yl-1,3-oxazol-2-yl)methanone?

The IUPAC name of (5-phenoxy-2,3-dihydro-1H-inden-2-yl)-(5-pyridin-2-yl-1,3-oxazol-2-yl)methanone (CID 54583373) is (5-phenoxy-2,3-dihydro-1H-inden-2-yl)-(5-pyridin-2-yl-1,3-oxazol-2-yl)methanone.

What is the SMILES notation for (5-phenoxy-2,3-dihydro-1H-inden-2-yl)-(5-pyridin-2-yl-1,3-oxazol-2-yl)methanone?

The canonical SMILES for (5-phenoxy-2,3-dihydro-1H-inden-2-yl)-(5-pyridin-2-yl-1,3-oxazol-2-yl)methanone is O=C(c1ncc(-c2ccccn2)o1)C1Cc2ccc(Oc3ccccc3)cc2C1.

What is the InChIKey of (5-phenoxy-2,3-dihydro-1H-inden-2-yl)-(5-pyridin-2-yl-1,3-oxazol-2-yl)methanone?

The InChIKey is RLFWFFNASDWVLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18N2O3/c27-23(24-26-15-22(29-24)21-8-4-5-11-25-21)18-12-16-9-10-20(14-17(16)13-18)28-19-6-2-1-3-7-19/h1-11,14-15,18H,12-13H2.

What are the key properties of (5-phenoxy-2,3-dihydro-1H-inden-2-yl)-(5-pyridin-2-yl-1,3-oxazol-2-yl)methanone?

(5-phenoxy-2,3-dihydro-1H-inden-2-yl)-(5-pyridin-2-yl-1,3-oxazol-2-yl)methanone has a molecular weight of 382.42 g/mol, XLogP of 5.13, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for (5-phenoxy-2,3-dihydro-1H-inden-2-yl)-(5-pyridin-2-yl-1,3-oxazol-2-yl)methanone is sourced from PubChem (CID 54583373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).