Basic information
- CAS
122892-32-4- Standard SMILES
O=C(NCc1ccc(OCCN2CCCC2)cc1)c1ccc2c(c1)OCO2- InChIKey
UNOOSJZCTDJNIF-UHFFFAOYSA-N- Molecular formula
- C21H24N2O4
- Average molar mass
- 368.4 g/mol
- Monoisotopic mass
- 368.17360725
Names & identifiers
- Preferred name
- 1,3-Benzodioxole-5-carboxamide, N-((4-(2-(1-pyrrolidinyl)ethoxy)phenyl)methyl)-
- IUPAC
- N-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]-1,3-benzodioxole-5-carboxamide
- English name
- 1,3-Benzodioxole-5-carboxamide, N-[[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]methyl]-
- Molecular formula
- C21H24N2O4
- Molecular weight
- 0
Names & synonyms
122892-32-43,4-Methylenedioxy-N-(4-(2-(1-pyrrolidinyl)ethoxy)benzyl)benzamideN-((4-(2-(1-Pyrrolidinyl)ethoxy)phenyl)methyl)-1,3-benzodioxole-5-carboxamide1,3-Benzodioxole-5-carboxamide, N-((4-(2-(1-pyrrolidinyl)ethoxy)phenyl)methyl)-1,3-Benzodioxole-5-carboxamide, N-[[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]methyl]-3,4-Methylenedioxy-N-[4-[2-(1-pyrrolidinyl)ethoxy]benzyl]benzamideN-[[4-[2-(1-Pyrrolidinyl)ethoxy]phenyl]methyl]-1,3-benzodioxole-5-carboxamideRefChem:217927UNOOSJZCTDJNIF-UHFFFAOYSA-NN-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]-1,3-benzodioxole-5-carboxamideSCHEMBL9815657DTXSID40924312
Show more names
N-({4-[2-(Pyrrolidin-1-yl)ethoxy]phenyl}methyl)-2H-1,3-benzodioxole-5-carboximidic acid
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 60 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 475
Related reactions
2 records
Compound notes
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