4-[(tert-Butoxycarbonylamino)methyl]pyridine
TL;DR: 4-[(tert-Butoxycarbonylamino)methyl]pyridine (CAS 135632-53-0) is a chemical compound with molecular formula C11H16N2O2 and molecular weight 208.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-(pyridin-4-ylmethyl)carbamate
Also Known As: 4-(Boc-aminomethyl)pyridine, N-Boc-4-aminomethylpyridine, tert-Butyl (pyridin-4-ylmethyl)carbamate, 4-[(tert-Butoxycarbonylamino)methyl]pyridine, tert-butyl N-(pyridin-4-ylmethyl)carbamate
| Molecular Formula | C11H16N2O2 |
|---|---|
| Molecular Weight | 208.12 g/mol |
| LogP | 2.1063 |
| Topological Polar Surface Area | 51.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.12119 |
| Heavy Atoms | 15 |
| Complexity | 317.10986 |
Chemical Identifiers
| CAS Number | 135632-53-0 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NCC1=CC=NC=C1 |
Product Overview
4-[(tert-Butoxycarbonylamino)methyl]pyridine (CAS 135632-53-0), with molecular formula C11H16N2O2 and molecular weight 208.12 g/mol. IUPAC: tert-butyl N-(pyridin-4-ylmethyl)carbamate.
Chemical Property Profile of 4-[(tert-Butoxycarbonylamino)methyl]pyridine
Property Insights of 4-[(tert-Butoxycarbonylamino)methyl]pyridine
The XLogP value of 2.1063 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(tert-Butoxycarbonylamino)methyl]pyridine. With a topological polar surface area (TPSA) of 51.22 Ų, 4-[(tert-Butoxycarbonylamino)methyl]pyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(tert-Butoxycarbonylamino)methyl]pyridine has 1 hydrogen bond donor(s) and 3 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 4-[(tert-Butoxycarbonylamino)methyl]pyridine?
The CAS number of 4-[(tert-Butoxycarbonylamino)methyl]pyridine is 135632-53-0.
What is the molecular formula of 4-[(tert-Butoxycarbonylamino)methyl]pyridine?
The molecular formula of 4-[(tert-Butoxycarbonylamino)methyl]pyridine is C11H16N2O2.
What is the molecular weight of 4-[(tert-Butoxycarbonylamino)methyl]pyridine?
The molecular weight of 4-[(tert-Butoxycarbonylamino)methyl]pyridine is 208.12 g/mol.
Where can I buy 4-[(tert-Butoxycarbonylamino)methyl]pyridine?
You can request a quote for 4-[(tert-Butoxycarbonylamino)methyl]pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(tert-Butoxycarbonylamino)methyl]pyridine?
Yes, KEHONG BIO provides custom synthesis services for 4-[(tert-Butoxycarbonylamino)methyl]pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.