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NPT

Summary
Name:NEOPENTYLAMINE
Formula:C5 H13 N
Formal charge:0
Formula weight:87.163 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.042,2-dimethylpropan-1-amine
OpenEye OEToolkits1.5.02,2-dimethylpropan-1-amine

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04NCC(C)(C)C
SMILES_CANONICALCACTVS3.341CC(C)(C)CN
SMILESCACTVS3.341CC(C)(C)CN
SMILES_CANONICALOpenEye OEToolkits1.5.0CC(C)(C)CN
SMILESOpenEye OEToolkits1.5.0CC(C)(C)CN
InChIInChI1.03InChI=1S/C5H13N/c1-5(2,3)4-6/h4,6H2,1-3H3
InChIKeyInChI1.03XDIAMRVROCPPBK-UHFFFAOYSA-N

246704

PDB entries from 2025-12-24

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