N-(3-cyclopentylpropyl)-3-[5-[(S)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methylpropanamide

C22H31N3O3 — CID 25292482

About N-(3-cyclopentylpropyl)-3-[5-[(S)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methylpropanamide

N-(3-cyclopentylpropyl)-3-[5-[(S)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methylpropanamide (PubChem CID 25292482) has the molecular formula C22H31N3O3 and a molecular weight of 385.51 g/mol. Its IUPAC name is N-(3-cyclopentylpropyl)-3-[5-[(S)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methylpropanamide.

Molecular Properties

• Compound Name: N-(3-cyclopentylpropyl)-3-[5-[(S)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methylpropanamide
• PubChem CID: 25292482
• Molecular Formula: C22H31N3O3
• Molecular Weight: 385.51 g/mol
• Exact Mass: 385.24
• IUPAC Name: N-(3-cyclopentylpropyl)-3-[5-[(S)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methylpropanamide
• SMILES: CO[C@@H](c1ccccc1)c1nnc(CCC(=O)N(C)CCCC2CCCC2)o1
• InChI: InChI=1S/C22H31N3O3/c1-25(16-8-11-17-9-6-7-10-17)20(26)15-14-19-23-24-22(28-19)21(27-2)18-12-4-3-5-13-18/h3-5,12-13,17,21H,6-11,14-16H2,1-2H3/t21-/m0/s1
• InChIKey: VNWVFINJXVZAOF-NRFANRHFSA-N
• XLogP: 4.17
• TPSA: 68.46 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 10
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	385.51
LogP ≤ 5	4.17
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopentylpropyl)-3-[5-[(S)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methylpropanamide?

The IUPAC name of N-(3-cyclopentylpropyl)-3-[5-[(S)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methylpropanamide (CID 25292482) is N-(3-cyclopentylpropyl)-3-[5-[(S)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methylpropanamide.

What is the SMILES notation for N-(3-cyclopentylpropyl)-3-[5-[(S)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methylpropanamide?

The canonical SMILES for N-(3-cyclopentylpropyl)-3-[5-[(S)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methylpropanamide is CO[C@@H](c1ccccc1)c1nnc(CCC(=O)N(C)CCCC2CCCC2)o1.

What is the InChIKey of N-(3-cyclopentylpropyl)-3-[5-[(S)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methylpropanamide?

The InChIKey is VNWVFINJXVZAOF-NRFANRHFSA-N. The full InChI is InChI=1S/C22H31N3O3/c1-25(16-8-11-17-9-6-7-10-17)20(26)15-14-19-23-24-22(28-19)21(27-2)18-12-4-3-5-13-18/h3-5,12-13,17,21H,6-11,14-16H2,1-2H3/t21-/m0/s1.

What are the key properties of N-(3-cyclopentylpropyl)-3-[5-[(S)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methylpropanamide?

N-(3-cyclopentylpropyl)-3-[5-[(S)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methylpropanamide has a molecular weight of 385.51 g/mol, XLogP of 4.17, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-(3-cyclopentylpropyl)-3-[5-[(S)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methylpropanamide is sourced from PubChem (CID 25292482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).