Anodyne| 1,3-DMBA | |
|---|---|
 | |
| Molecular structure via molpic | |
| Conformer structure via 3Dmol.js | |
| Molecular formula | C6H15N[1] |
| Molecular mass | 101.19 g/mol[1] |
| Density | 0.75 at 68 °F (NTP, 1992) - Less dense than water; will float g/cm3[1] |
| Predicted LogP | 1.4[1] |
| Boiling point | 223 to 228 °F at 760 mmHg (NTP, 1992)[1] |
| Chirality | racemic[2] |
| Identifiers [] | |
|---|---|
| IUPAC name | 4-methylpentan-2-amine[1] |
| SMILES | CC(C)CC(C)N[1] |
| InChI | InChI=1S/C6H15N/c1-5(2)4-6(3)7/h5-6H,4,7H2,1-3H3[1] |
| InChIKey | UNBMPKNTYKDYCG-UHFFFAOYSA-N[1] |
| Dosing |
|---|
1,3-Dimethylbutylamine
1,3-Dimethylbutylamine (also known as 2-Amino-4-methylpentane, 2-Pentanamine, 4-methyl-, 4-Methyl-2-aminopentane, 1,3-Dimethylbutanamine, Butylamine, 1,3-dimethyl-, 1,3-Dimethyl butylamine, CCRIS 4800, Pentergy, 4-amino-2-methylpentane or 1,3-Dimethyl-n-butylamine)
Chemistry
Stereochemistry
(RS)-1,3-Dimethylbutylamine is a racemic mixture of the optical stereoisomers:
| Stereoisomers [] |
|---|
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(-)-1,3-Dimethylbutylamine -1,3-dimethylbutylamine.svg)
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See also
External links
- 1,3-Dimethylbutylamine (Wikipedia)
- 1,3-Dimethylbutylamine (Wikidata)
- 1,3-Dimethylbutylamine (PubChem)
- 1,3-Dimethylbutylamine (ChEMBL)
- 1,3-Dimethylbutylamine (Probes & Drugs)
- 1,3-Dimethylbutylamine (Common Chemistry)
- 1,3-Dimethylbutylamine (UNII)
- 1,3-Dimethylbutylamine (EPA DSSTox)
References
National Center for Biotechnology Information. PubChem Compound Summary for CID 7908, 1,3-Dimethylbutylamine. Accessed June 17, 2025. https://pubchem.ncbi.nlm.nih.gov/compound/7908.
U.S. Food and Drug Administration; National Center for Advancing Translational Sciences. 1,3-Dimethylbutylamine. UNII: KXP599H5R6. Global Substance Registration System. Accessed June 17, 2025. https://gsrs.ncats.nih.gov/ginas/app/beta/substances/KXP599H5R6