Butyranilide, 4-(diethylamino)-3'-ethyl-

HCID 57259

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Basic information

CAS: 97554-22-8
Standard SMILES: CCc1cccc(NC(=O)CCCN(CC)CC)c1
InChIKey: UATBFOLZKRMHKB-UHFFFAOYSA-N
Molecular formula: C16H26N2O
Average molar mass: 262.39 g/mol
Monoisotopic mass: 262.20451346

Names & identifiers

Preferred name: Butyranilide, 4-(diethylamino)-3'-ethyl-
IUPAC: 4-(diethylamino)-N-(3-ethylphenyl)butanamide

Names & synonyms

BRN 2731377BUTYRANILIDE, 4-(DIETHYLAMINO)-3'-ETHYL-97554-22-84-(Diethylamino)-3'-ethylbutyranilidegamma-Diaethylamino-3-aethyl-butyranilid [German]gamma-Diaethylamino-3-aethyl-butyranilidDTXSID40243035RefChem:331217DTXCID401655264-(diethylamino)-N-(3-ethylphenyl)butanamideBRN 2731377, 4-(Diethylamino)-3-ethylbutyranilide, gamma-Diaethylamino-3-aethyl-butyranilid [German], BUTYRANILIDE, 4-(DIETHYLAMINO)-3-ETHYL-, AC1L1MMG, gamma-Diaethylamino-3-aethyl-butyranilid, LS-47758, 4-(diethylamino)-N-(3-ethylphenyl)butanamide, 97554-22-8

Database identifiers

CAS: 97554-22-8
PubChem CID: 57259
DTXSID: DTXSID40243035

Properties

Computed structural properties

XLogP: 3.4
Topological polar surface area: 32.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 8
Heavy atoms: 19
Formal charge: 0
Complexity: 251

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