3-Chloro-N-(3,3-diphenyl-propyl)-propionamide

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Basic information

CAS: 573995-31-0
Standard SMILES: O=C(CCCl)NCCC(c1ccccc1)c1ccccc1
InChIKey: JBCFGAKJHQOHGC-UHFFFAOYSA-N
Molecular formula: C18H20ClNO
Average molar mass: 301.8 g/mol
Monoisotopic mass: 301.123342

Names & identifiers

Preferred name: 3-Chloro-N-(3,3-diphenyl-propyl)-propionamide
IUPAC: 3-chloro-N-(3,3-diphenylpropyl)propanamide

Names & synonyms

3-Chloro-N-(3,3-diphenyl-propyl)-propionamide573995-31-03-chloro-N-(3,3-diphenylpropyl)propanamideSCHEMBL5468000DTXSID50393797JBCFGAKJHQOHGC-UHFFFAOYSA-NAKOS003852151

Database identifiers

CAS: 573995-31-0
PubChem CID: 3575835
DTXSID: DTXSID50393797

Properties

Computed structural properties

XLogP: 3.8
Topological polar surface area: 29.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 7
Heavy atoms: 21
Formal charge: 0
Complexity: 278

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Compound notes

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