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F1V

Summary
Name:N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-2,2-dimethylpropanamide
Formula:C16 H22 N2 O2
Formal charge:0
Formula weight:274.358 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-2,2-dimethylpropanamide
OpenEye OEToolkits2.0.6~{N}-[2-(5-methoxy-1~{H}-indol-3-yl)ethyl]-2,2-dimethyl-propanamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01c1(OC)ccc2c(c1)c(CCNC(=O)C(C)(C)C)cn2
InChIInChI1.03InChI=1S/C16H22N2O2/c1-16(2,3)15(19)17-8-7-11-10-18-14-6-5-12(20-4)9-13(11)14/h5-6,9-10,18H,7-8H2,1-4H3,(H,17,19)
InChIKeyInChI1.03CUMVZJLZCUYFCZ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385COc1ccc2[nH]cc(CCNC(=O)C(C)(C)C)c2c1
SMILESCACTVS3.385COc1ccc2[nH]cc(CCNC(=O)C(C)(C)C)c2c1
SMILES_CANONICALOpenEye OEToolkits2.0.6CC(C)(C)C(=O)NCCc1c[nH]c2c1cc(cc2)OC
SMILESOpenEye OEToolkits2.0.6CC(C)(C)C(=O)NCCc1c[nH]c2c1cc(cc2)OC

218853

PDB entries from 2024-04-24

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