(2R)-2-(2-fluorophenoxy)-N-[4-(4-propan-2-yloxyphenyl)-1,2,5-oxadiazol-3-yl]propanamide

C20H20FN3O4 — CID 42278337

About (2R)-2-(2-fluorophenoxy)-N-[4-(4-propan-2-yloxyphenyl)-1,2,5-oxadiazol-3-yl]propanamide

(2R)-2-(2-fluorophenoxy)-N-[4-(4-propan-2-yloxyphenyl)-1,2,5-oxadiazol-3-yl]propanamide (PubChem CID 42278337) has the molecular formula C20H20FN3O4 and a molecular weight of 385.40 g/mol. Its IUPAC name is (2R)-2-(2-fluorophenoxy)-N-[4-(4-propan-2-yloxyphenyl)-1,2,5-oxadiazol-3-yl]propanamide.

Molecular Properties

• Compound Name: (2R)-2-(2-fluorophenoxy)-N-[4-(4-propan-2-yloxyphenyl)-1,2,5-oxadiazol-3-yl]propanamide
• PubChem CID: 42278337
• Molecular Formula: C20H20FN3O4
• Molecular Weight: 385.40 g/mol
• Exact Mass: 385.14
• IUPAC Name: (2R)-2-(2-fluorophenoxy)-N-[4-(4-propan-2-yloxyphenyl)-1,2,5-oxadiazol-3-yl]propanamide
• SMILES: CC(C)Oc1ccc(-c2nonc2NC(=O)[C@@H](C)Oc2ccccc2F)cc1
• InChI: InChI=1S/C20H20FN3O4/c1-12(2)26-15-10-8-14(9-11-15)18-19(24-28-23-18)22-20(25)13(3)27-17-7-5-4-6-16(17)21/h4-13H,1-3H3,(H,22,24,25)/t13-/m1/s1
• InChIKey: AONCOZFYGIVYFX-CYBMUJFWSA-N
• XLogP: 4.07
• TPSA: 86.48 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 7
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	385.40
LogP ≤ 5	4.07
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-fluorophenoxy)-N-[4-(4-propan-2-yloxyphenyl)-1,2,5-oxadiazol-3-yl]propanamide?

The IUPAC name of (2R)-2-(2-fluorophenoxy)-N-[4-(4-propan-2-yloxyphenyl)-1,2,5-oxadiazol-3-yl]propanamide (CID 42278337) is (2R)-2-(2-fluorophenoxy)-N-[4-(4-propan-2-yloxyphenyl)-1,2,5-oxadiazol-3-yl]propanamide.

What is the SMILES notation for (2R)-2-(2-fluorophenoxy)-N-[4-(4-propan-2-yloxyphenyl)-1,2,5-oxadiazol-3-yl]propanamide?

The canonical SMILES for (2R)-2-(2-fluorophenoxy)-N-[4-(4-propan-2-yloxyphenyl)-1,2,5-oxadiazol-3-yl]propanamide is CC(C)Oc1ccc(-c2nonc2NC(=O)[C@@H](C)Oc2ccccc2F)cc1.

What is the InChIKey of (2R)-2-(2-fluorophenoxy)-N-[4-(4-propan-2-yloxyphenyl)-1,2,5-oxadiazol-3-yl]propanamide?

The InChIKey is AONCOZFYGIVYFX-CYBMUJFWSA-N. The full InChI is InChI=1S/C20H20FN3O4/c1-12(2)26-15-10-8-14(9-11-15)18-19(24-28-23-18)22-20(25)13(3)27-17-7-5-4-6-16(17)21/h4-13H,1-3H3,(H,22,24,25)/t13-/m1/s1.

What are the key properties of (2R)-2-(2-fluorophenoxy)-N-[4-(4-propan-2-yloxyphenyl)-1,2,5-oxadiazol-3-yl]propanamide?

(2R)-2-(2-fluorophenoxy)-N-[4-(4-propan-2-yloxyphenyl)-1,2,5-oxadiazol-3-yl]propanamide has a molecular weight of 385.40 g/mol, XLogP of 4.07, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for (2R)-2-(2-fluorophenoxy)-N-[4-(4-propan-2-yloxyphenyl)-1,2,5-oxadiazol-3-yl]propanamide is sourced from PubChem (CID 42278337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).