1H-Imidazole-4-ethanamine, alpha,5-dimethyl-
TL;DR: 1H-Imidazole-4-ethanamine, alpha,5-dimethyl- (CAS 82977-50-2) is a chemical compound with molecular formula C7H13N3 and molecular weight 139.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-methyl-1H-imidazol-4-yl)propan-2-amine
Also Known As: alpha,5-Dimethylhistamine, NIOSH/NI3506570, 1H-Imidazole-4-ethanamine, alpha,5-dimethyl-, 4-(2-Aminopropyl)-5-methylimidazole, 4-(2-aminopropyl)-5-methyl-imidazol
| Molecular Formula | C7H13N3 |
|---|---|
| Molecular Weight | 139.11 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 54.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 139.11095 |
| Heavy Atoms | 10 |
| Complexity | 105.0 |
Chemical Identifiers
| CAS Number | 82977-50-2 |
|---|---|
| SMILES | CC1=C(N=CN1)CC(C)N |
| InChIKey | VULHNWNHMRINQS-UHFFFAOYSA-N |
Product Overview
1H-Imidazole-4-ethanamine, alpha,5-dimethyl- (CAS 82977-50-2), with molecular formula C7H13N3 and molecular weight 139.11 g/mol. IUPAC: 1-(5-methyl-1H-imidazol-4-yl)propan-2-amine.
Chemical Property Profile of 1H-Imidazole-4-ethanamine, alpha,5-dimethyl-
Property Insights of 1H-Imidazole-4-ethanamine, alpha,5-dimethyl-
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Imidazole-4-ethanamine, alpha,5-dimethyl-. With a topological polar surface area (TPSA) of 54.7 Ų, 1H-Imidazole-4-ethanamine, alpha,5-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Imidazole-4-ethanamine, alpha,5-dimethyl- has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1H-Imidazole-4-ethanamine, alpha,5-dimethyl-?
The CAS number of 1H-Imidazole-4-ethanamine, alpha,5-dimethyl- is 82977-50-2.
What is the molecular formula of 1H-Imidazole-4-ethanamine, alpha,5-dimethyl-?
The molecular formula of 1H-Imidazole-4-ethanamine, alpha,5-dimethyl- is C7H13N3.
What is the molecular weight of 1H-Imidazole-4-ethanamine, alpha,5-dimethyl-?
The molecular weight of 1H-Imidazole-4-ethanamine, alpha,5-dimethyl- is 139.11 g/mol.
Where can I buy 1H-Imidazole-4-ethanamine, alpha,5-dimethyl-?
You can request a quote for 1H-Imidazole-4-ethanamine, alpha,5-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Imidazole-4-ethanamine, alpha,5-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Imidazole-4-ethanamine, alpha,5-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.