2-(4-chlorophenoxy)-N-(propan-2-ylideneamino)propanamide

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Basic information

CAS: 5601-92-3
Standard SMILES: CC(C)=NNC(=O)C(C)Oc1ccc(Cl)cc1
InChIKey: RGMHPDSGWFKBMW-UHFFFAOYSA-N
Molecular formula: C12H15ClN2O2
Average molar mass: 254.71 g/mol
Monoisotopic mass: 254.0822054

Names & identifiers

Preferred name: 2-(4-chlorophenoxy)-N-(propan-2-ylideneamino)propanamide
IUPAC: 2-(4-chlorophenoxy)-N-(propan-2-ylideneamino)propanamide

Names & synonyms

5601-92-32-(4-chlorophenoxy)-N-(propan-2-ylideneamino)propanamide2-(4-chlorophenoxy)-N'-(1-methylethylidene)propanohydrazideCBMicro_025517DTXSID40386178CCG-12664AKOS024328835BIM-0025515.P001SR-01000214629SR-01000214629-12-(4-CHLOROPHENOXY)-N'-(PROPAN-2-YLIDENE)PROPANEHYDRAZIDE

Database identifiers

CAS: 5601-92-3
PubChem CID: 2854565
DTXSID: DTXSID40386178

Properties

Computed structural properties

XLogP: 2.5
Topological polar surface area: 50.7 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 4
Heavy atoms: 17
Formal charge: 0
Complexity: 282

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Compound notes

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