1-Amino-4,4-dimethyl-1-(2-pyridinyl)-1-penten-3-one
TL;DR: 1-Amino-4,4-dimethyl-1-(2-pyridinyl)-1-penten-3-one (CAS 1164515-59-6) is a chemical compound with molecular formula C12H16N2O and molecular weight 204.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-1-amino-4,4-dimethyl-1-pyridin-2-ylpent-1-en-3-one
Also Known As: 1-amino-4,4-dimethyl-1-(2-pyridinyl)-1-penten-3-one, (Z)-1-amino-4,4-dimethyl-1-pyridin-2-ylpent-1-en-3-one, A1923/0080880, (1Z)-1-amino-4,4-dimethyl-1-(2-pyridyl)pent-1-en-3-one, (1Z)-1-amino-4,4-dimethyl-1-(pyridin-2-yl)pent-1-en-3-one
| Molecular Formula | C12H16N2O |
|---|---|
| Molecular Weight | 204.13 g/mol |
| LogP | 1.9964 |
| Topological Polar Surface Area | 55.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 204.12627 |
| Heavy Atoms | 15 |
| Complexity | 374.35864 |
Chemical Identifiers
| CAS Number | 1164515-59-6 |
|---|---|
| SMILES | CC(C)(C)C(=O)/C=C(/C1=CC=CC=N1)\N |
Product Overview
1-Amino-4,4-dimethyl-1-(2-pyridinyl)-1-penten-3-one (CAS 1164515-59-6), with molecular formula C12H16N2O and molecular weight 204.13 g/mol. IUPAC: (Z)-1-amino-4,4-dimethyl-1-pyridin-2-ylpent-1-en-3-one.
Chemical Property Profile of 1-Amino-4,4-dimethyl-1-(2-pyridinyl)-1-penten-3-one
Property Insights of 1-Amino-4,4-dimethyl-1-(2-pyridinyl)-1-penten-3-one
The XLogP value of 1.9964 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Amino-4,4-dimethyl-1-(2-pyridinyl)-1-penten-3-one. With a topological polar surface area (TPSA) of 55.98 Ų, 1-Amino-4,4-dimethyl-1-(2-pyridinyl)-1-penten-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Amino-4,4-dimethyl-1-(2-pyridinyl)-1-penten-3-one 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 1-Amino-4,4-dimethyl-1-(2-pyridinyl)-1-penten-3-one?
The CAS number of 1-Amino-4,4-dimethyl-1-(2-pyridinyl)-1-penten-3-one is 1164515-59-6.
What is the molecular formula of 1-Amino-4,4-dimethyl-1-(2-pyridinyl)-1-penten-3-one?
The molecular formula of 1-Amino-4,4-dimethyl-1-(2-pyridinyl)-1-penten-3-one is C12H16N2O.
What is the molecular weight of 1-Amino-4,4-dimethyl-1-(2-pyridinyl)-1-penten-3-one?
The molecular weight of 1-Amino-4,4-dimethyl-1-(2-pyridinyl)-1-penten-3-one is 204.13 g/mol.
Where can I buy 1-Amino-4,4-dimethyl-1-(2-pyridinyl)-1-penten-3-one?
You can request a quote for 1-Amino-4,4-dimethyl-1-(2-pyridinyl)-1-penten-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Amino-4,4-dimethyl-1-(2-pyridinyl)-1-penten-3-one?
Yes, KEHONG BIO provides custom synthesis services for 1-Amino-4,4-dimethyl-1-(2-pyridinyl)-1-penten-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.