3,4-二氢-1-甲基-2-(3-吡啶基)-2H-吡咯鎓
TL;DR: 3,4-二氢-1-甲基-2-(3-吡啶基)-2H-吡咯鎓 (CAS 72344-33-3) is a chemical compound with molecular formula C10H13N2+ and molecular weight 161.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-二氢-1-甲基-2-(3-吡啶基)-2H-吡咯鎓
3-(1-methyl-3,4-dihydro-2H-pyrrol-1-ium-2-yl)pyridine
Also Known As: nicotine imine, nicotine iminium, 11C-nicotine imine, nicotine-delta 1'-(5')-iminium, Nicotine delta 1'(5)' iminium ion
| Molecular Formula | C10H13N2+ |
|---|---|
| Molecular Weight | 161.11 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 15.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 161.10788 |
| Heavy Atoms | 12 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 72344-33-3 |
|---|---|
| SMILES | C[N+]1=CCCC1C2=CN=CC=C2 |
| InChIKey | GTQXYYYOJZZJHL-UHFFFAOYSA-N |
Product Overview
3,4-二氢-1-甲基-2-(3-吡啶基)-2H-吡咯鎓 (CAS 72344-33-3), with molecular formula C10H13N2+ and molecular weight 161.11 g/mol. IUPAC: 3-(1-methyl-3,4-dihydro-2H-pyrrol-1-ium-2-yl)pyridine.
Chemical Property Profile of 3,4-二氢-1-甲基-2-(3-吡啶基)-2H-吡咯鎓
Property Insights of 3,4-二氢-1-甲基-2-(3-吡啶基)-2H-吡咯鎓
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-二氢-1-甲基-2-(3-吡啶基)-2H-吡咯鎓. With a topological polar surface area (TPSA) of 15.9 Ų, 3,4-二氢-1-甲基-2-(3-吡啶基)-2H-吡咯鎓 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-二氢-1-甲基-2-(3-吡啶基)-2H-吡咯鎓 has 0 hydrogen bond donor(s) and 1 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 3,4-二氢-1-甲基-2-(3-吡啶基)-2H-吡咯鎓?
The CAS number of 3,4-二氢-1-甲基-2-(3-吡啶基)-2H-吡咯鎓 is 72344-33-3.
What is the molecular formula of 3,4-二氢-1-甲基-2-(3-吡啶基)-2H-吡咯鎓?
The molecular formula of 3,4-二氢-1-甲基-2-(3-吡啶基)-2H-吡咯鎓 is C10H13N2+.
What is the molecular weight of 3,4-二氢-1-甲基-2-(3-吡啶基)-2H-吡咯鎓?
The molecular weight of 3,4-二氢-1-甲基-2-(3-吡啶基)-2H-吡咯鎓 is 161.11 g/mol.
Where can I buy 3,4-二氢-1-甲基-2-(3-吡啶基)-2H-吡咯鎓?
You can request a quote for 3,4-二氢-1-甲基-2-(3-吡啶基)-2H-吡咯鎓 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-二氢-1-甲基-2-(3-吡啶基)-2H-吡咯鎓?
Yes, KEHONG BIO provides custom synthesis services for 3,4-二氢-1-甲基-2-(3-吡啶基)-2H-吡咯鎓 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.