3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methyl-N-(thiophen-3-ylmethyl)propanamide

C19H21N3O3S — CID 25306442

About 3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methyl-N-(thiophen-3-ylmethyl)propanamide

3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methyl-N-(thiophen-3-ylmethyl)propanamide (PubChem CID 25306442) has the molecular formula C19H21N3O3S and a molecular weight of 371.46 g/mol. Its IUPAC name is 3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methyl-N-(thiophen-3-ylmethyl)propanamide.

Molecular Properties

• Compound Name: 3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methyl-N-(thiophen-3-ylmethyl)propanamide
• PubChem CID: 25306442
• Molecular Formula: C19H21N3O3S
• Molecular Weight: 371.46 g/mol
• Exact Mass: 371.13
• IUPAC Name: 3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methyl-N-(thiophen-3-ylmethyl)propanamide
• SMILES: CO[C@H](c1ccccc1)c1nnc(CCC(=O)N(C)Cc2ccsc2)o1
• InChI: InChI=1S/C19H21N3O3S/c1-22(12-14-10-11-26-13-14)17(23)9-8-16-20-21-19(25-16)18(24-2)15-6-4-3-5-7-15/h3-7,10-11,13,18H,8-9,12H2,1-2H3/t18-/m1/s1
• InChIKey: RCCDMVBMGZBROT-GOSISDBHSA-N
• XLogP: 3.46
• TPSA: 68.46 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 8
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	371.46
LogP ≤ 5	3.46
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methyl-N-(thiophen-3-ylmethyl)propanamide?

The IUPAC name of 3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methyl-N-(thiophen-3-ylmethyl)propanamide (CID 25306442) is 3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methyl-N-(thiophen-3-ylmethyl)propanamide.

What is the SMILES notation for 3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methyl-N-(thiophen-3-ylmethyl)propanamide?

The canonical SMILES for 3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methyl-N-(thiophen-3-ylmethyl)propanamide is CO[C@H](c1ccccc1)c1nnc(CCC(=O)N(C)Cc2ccsc2)o1.

What is the InChIKey of 3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methyl-N-(thiophen-3-ylmethyl)propanamide?

The InChIKey is RCCDMVBMGZBROT-GOSISDBHSA-N. The full InChI is InChI=1S/C19H21N3O3S/c1-22(12-14-10-11-26-13-14)17(23)9-8-16-20-21-19(25-16)18(24-2)15-6-4-3-5-7-15/h3-7,10-11,13,18H,8-9,12H2,1-2H3/t18-/m1/s1.

What are the key properties of 3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methyl-N-(thiophen-3-ylmethyl)propanamide?

3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methyl-N-(thiophen-3-ylmethyl)propanamide has a molecular weight of 371.46 g/mol, XLogP of 3.46, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methyl-N-(thiophen-3-ylmethyl)propanamide is sourced from PubChem (CID 25306442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).