Basic information
- CAS
66968-18-1- Standard SMILES
CCCC1(c2cccc(OC)c2)CN(CCc2ccc(N)cc2)C1- InChIKey
JKCBCFOGBHTOCJ-UHFFFAOYSA-N- Molecular formula
- C21H28N2O
- Average molar mass
- 324.5 g/mol
- Monoisotopic mass
- 324.22016352
Names & identifiers
- Preferred name
- Azetidine, 1-(p-aminophenethyl)-3-(m-methoxyphenyl)-3-propyl-
- IUPAC
- 4-[2-[3-(3-methoxyphenyl)-3-propylazetidin-1-yl]ethyl]aniline
- English name
- 4-[2-[3-(m-Methoxyphenyl)-3-propyl-1-azetidinyl]ethyl]aniline
- Molecular formula
- C21H28N2O
- Molecular weight
- 324.46
Names & synonyms
66968-18-1AZETIDINE, 1-(p-AMINOPHENETHYL)-3-(m-METHOXYPHENYL)-3-PROPYL-1-(p-Aminophenethyl)-3-(m-methoxyphenyl)-3-propylazetidineDTXSID30217169RefChem:320333DTXCID801396604-{2-[3-(3-methoxyphenyl)-3-propylazetidin-1-yl]ethyl}aniline4-[2-[3-(m-Methoxyphenyl)-3-propyl-1-azetidinyl]ethyl]anilineBenzenamine, 4-[2-[3-(3-methoxyphenyl)-3-propyl-1-azetidinyl]ethyl]-
Database identifiers
- CAS
66968-18-1- PubChem CID
- 48718
- DTXSID
DTXSID30217169- Nikkaji
- J84.659G
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 38.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 372
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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