[2-[[6-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]-3-pyridinyl]methoxy]-3-pyridinyl]methanol

C23H21N3O4 — CID 68884273

About [2-[[6-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]-3-pyridinyl]methoxy]-3-pyridinyl]methanol

[2-[[6-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]-3-pyridinyl]methoxy]-3-pyridinyl]methanol (PubChem CID 68884273) has the molecular formula C23H21N3O4 and a molecular weight of 403.44 g/mol. Its IUPAC name is [2-[[6-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]-3-pyridinyl]methoxy]-3-pyridinyl]methanol.

Molecular Properties

• Compound Name: [2-[[6-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]-3-pyridinyl]methoxy]-3-pyridinyl]methanol
• PubChem CID: 68884273
• Molecular Formula: C23H21N3O4
• Molecular Weight: 403.44 g/mol
• Exact Mass: 403.15
• IUPAC Name: [2-[[6-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]-3-pyridinyl]methoxy]-3-pyridinyl]methanol
• SMILES: Cc1oc(-c2ccccc2)nc1COc1ccc(COc2ncccc2CO)cn1
• InChI: InChI=1S/C23H21N3O4/c1-16-20(26-23(30-16)18-6-3-2-4-7-18)15-28-21-10-9-17(12-25-21)14-29-22-19(13-27)8-5-11-24-22/h2-12,27H,13-15H2,1H3
• InChIKey: QXCPYIFXGAFBCR-UHFFFAOYSA-N
• XLogP: 4.09
• TPSA: 90.50 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 8
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	403.44
LogP ≤ 5	4.09
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of [2-[[6-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]-3-pyridinyl]methoxy]-3-pyridinyl]methanol?

The IUPAC name of [2-[[6-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]-3-pyridinyl]methoxy]-3-pyridinyl]methanol (CID 68884273) is [2-[[6-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]-3-pyridinyl]methoxy]-3-pyridinyl]methanol.

What is the SMILES notation for [2-[[6-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]-3-pyridinyl]methoxy]-3-pyridinyl]methanol?

The canonical SMILES for [2-[[6-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]-3-pyridinyl]methoxy]-3-pyridinyl]methanol is Cc1oc(-c2ccccc2)nc1COc1ccc(COc2ncccc2CO)cn1.

What is the InChIKey of [2-[[6-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]-3-pyridinyl]methoxy]-3-pyridinyl]methanol?

The InChIKey is QXCPYIFXGAFBCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O4/c1-16-20(26-23(30-16)18-6-3-2-4-7-18)15-28-21-10-9-17(12-25-21)14-29-22-19(13-27)8-5-11-24-22/h2-12,27H,13-15H2,1H3.

What are the key properties of [2-[[6-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]-3-pyridinyl]methoxy]-3-pyridinyl]methanol?

[2-[[6-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]-3-pyridinyl]methoxy]-3-pyridinyl]methanol has a molecular weight of 403.44 g/mol, XLogP of 4.09, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for [2-[[6-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]-3-pyridinyl]methoxy]-3-pyridinyl]methanol is sourced from PubChem (CID 68884273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).