NSD
Summary
Name: | N-(3-aminopropyl)propane-1,3-diamine |
Formula: | C6 H17 N3 |
Formal charge: | 0 |
Formula weight: | 131.219 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | N-(3-aminopropyl)propane-1,3-diamine |
OpenEye OEToolkits | 1.7.0 | N'-(3-azanylpropyl)propane-1,3-diamine |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | NCCCNCCCN |
SMILES_CANONICAL | CACTVS | 3.370 | NCCCNCCCN |
SMILES | CACTVS | 3.370 | NCCCNCCCN |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | C(CN)CNCCCN |
SMILES | OpenEye OEToolkits | 1.7.0 | C(CN)CNCCCN |
InChI | InChI | 1.03 | InChI=1S/C6H17N3/c7-3-1-5-9-6-2-4-8/h9H,1-8H2 |
InChIKey | InChI | 1.03 | OTBHHUPVCYLGQO-UHFFFAOYSA-N |