Acetamide, N-(4-(3-(4-(2-methoxyphenyl)-1-piperazinyl)propoxy)phenyl)-

HCID 55421

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Basic information

CAS: 85868-53-7
Standard SMILES: COc1ccccc1N1CCN(CCCOc2ccc(NC(C)=O)cc2)CC1
InChIKey: CLCFXDSSPUCCKP-UHFFFAOYSA-N
Molecular formula: C22H29N3O3
Average molar mass: 383.5 g/mol
Monoisotopic mass: 383.2208918

Names & identifiers

Preferred name: Acetamide, N-(4-(3-(4-(2-methoxyphenyl)-1-piperazinyl)propoxy)phenyl)-
IUPAC: N-[4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenyl]acetamide

Names & synonyms

BRN 4019111ACETAMIDE, N-(4-(3-(4-(2-METHOXYPHENYL)-1-PIPERAZINYL)PROPOXY)PHENYL)-85868-53-7DTXSID40235157N-(4-(3-(4-(2-Methoxyphenyl)-1-piperazinyl)propoxy)phenyl)acetamideRefChem:315318DTXCID40157648CHEMBL4789422BDBM50561092N-(4-{3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy}phenyl)acetamide

Database identifiers

CAS: 85868-53-7
PubChem CID: 55421
DTXSID: DTXSID40235157
ChEMBL: CHEMBL4789422

Properties

Computed structural properties

XLogP: 3
Topological polar surface area: 54 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 8
Heavy atoms: 28
Formal charge: 0
Complexity: 460

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