EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | (CH2)n.C4H10N2O |
| Net Charge | 0 |
| Average Mass | 116.164 |
| Monoisotopic Mass | 116.09496 |
| SMILES | CC(=O)NCCCN |
| InChI | InChI=1S/C5H12N2O/c1-5(8)7-4-2-3-6/h2-4,6H2,1H3,(H,7,8) |
| InChIKey | YFZBPSXRYCOKCW-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-monoacetylalkane-α,ω-diamine (CHEBI:35414) has functional parent alkane-α,ω-diamine (CHEBI:35411) |
| N-monoacetylalkane-α,ω-diamine (CHEBI:35414) is a acetamides (CHEBI:22160) |
| N-monoacetylalkane-α,ω-diamine (CHEBI:35414) is a primary amino compound (CHEBI:50994) |
| N-monoacetylalkane-α,ω-diamine (CHEBI:35414) is conjugate base of N-monoacetylalkane-α,ω-diamine(1+) (CHEBI:70988) |
| Incoming Relation(s) |
| N-acetylputrescine (CHEBI:17768) is a N-monoacetylalkane-α,ω-diamine (CHEBI:35414) |
| N-monoacetylalkane-α,ω-diamine(1+) (CHEBI:70988) is conjugate acid of N-monoacetylalkane-α,ω-diamine (CHEBI:35414) |
| Synonyms | Source |
|---|---|
| N-Acetyldiamine | KEGG COMPOUND |
| N-acetyldiamines | ChEBI |
| N-monoacetylalkane-α,ω-diamines | ChEBI |
| Manual Xrefs | Databases |
|---|---|
| C02297 | KEGG COMPOUND |