Propionanilide, N-(1-phenethyl-3-pyrrolidinylmethyl)-, oxalate

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Basic information

CAS: 30380-48-4
Standard SMILES: CCC(=O)N(CC1CCN(CCc2ccccc2)C1)c1ccccc1.O=C(O)C(=O)O
InChIKey: RURPPZSMIXRWOV-UHFFFAOYSA-N
Molecular formula: C24H30N2O5
Average molar mass: 426.5 g/mol
Monoisotopic mass: 426.21547206

Names & identifiers

Preferred name: Propionanilide, N-(1-phenethyl-3-pyrrolidinylmethyl)-, oxalate
IUPAC: oxalic acid;N-phenyl-N-[[1-(2-phenylethyl)pyrrolidin-3-yl]methyl]propanamide

Names & synonyms

Propionanilide, N-(1-phenethyl-3-pyrrolidinylmethyl)-, oxalate30380-48-4N-(1-Phenethyl-3-pyrrolidinylmethyl)-N-phenylpropioamide oxalateRefChem:375069DTXSID10952723Oxalic acid--N-phenyl-N-{[1-(2-phenylethyl)pyrrolidin-3-yl]methyl}propanamide (1/1)

Database identifiers

CAS: 30380-48-4
PubChem CID: 207647
DTXSID: DTXSID10952723

Properties

Computed structural properties

Topological polar surface area: 98.2 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 6
Rotatable bonds: 8
Heavy atoms: 31
Formal charge: 0
Complexity: 470

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Compound notes

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