![2-[(1,2-Dimethyl-3-piperidinyl)methyl]-3H-indol-3-one structure](/static/products/5498/54986-55-9.webp)
2-[(1,2-Dimethyl-3-piperidinyl)methyl]-3H-indol-3-one
TL;DR: 2-[(1,2-Dimethyl-3-piperidinyl)methyl]-3H-indol-3-one (CAS 54986-55-9) is a chemical compound with molecular formula C16H20N2O and molecular weight 256.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(1,2-dimethylpiperidin-3-yl)methyl]indol-3-one
Also Known As: 2-[methyl]-3h-indol-3-one, 2-[ methyl]-3H-indol-3-one, 2-[(1,2-Dimethyl-3-piperidinyl)methyl]-3H-indol-3-one, 2-[(1,2-dimethylpiperidin-3-yl)methyl]indol-3-one, 3H-Indol-3-one, 2-[(1,2-dimethyl-3-piperidinyl)methyl]-
| Molecular Formula | C16H20N2O |
|---|---|
| Molecular Weight | 256.16 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.15756 |
| Heavy Atoms | 19 |
| Complexity | 390.0 |
Chemical Identifiers
| CAS Number | 54986-55-9 |
|---|---|
| SMILES | CC1C(CCCN1C)CC2=NC3=CC=CC=C3C2=O |
| InChIKey | UGIJSHKVVAZQDJ-UHFFFAOYSA-N |
Product Overview
2-[(1,2-Dimethyl-3-piperidinyl)methyl]-3H-indol-3-one (CAS 54986-55-9), with molecular formula C16H20N2O and molecular weight 256.16 g/mol. IUPAC: 2-[(1,2-dimethylpiperidin-3-yl)methyl]indol-3-one.
Chemical Property Profile of 2-[(1,2-Dimethyl-3-piperidinyl)methyl]-3H-indol-3-one
Property Insights of 2-[(1,2-Dimethyl-3-piperidinyl)methyl]-3H-indol-3-one
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(1,2-Dimethyl-3-piperidinyl)methyl]-3H-indol-3-one. With a topological polar surface area (TPSA) of 32.7 Ų, 2-[(1,2-Dimethyl-3-piperidinyl)methyl]-3H-indol-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(1,2-Dimethyl-3-piperidinyl)methyl]-3H-indol-3-one has 0 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 2-[(1,2-Dimethyl-3-piperidinyl)methyl]-3H-indol-3-one?
The CAS number of 2-[(1,2-Dimethyl-3-piperidinyl)methyl]-3H-indol-3-one is 54986-55-9.
What is the molecular formula of 2-[(1,2-Dimethyl-3-piperidinyl)methyl]-3H-indol-3-one?
The molecular formula of 2-[(1,2-Dimethyl-3-piperidinyl)methyl]-3H-indol-3-one is C16H20N2O.
What is the molecular weight of 2-[(1,2-Dimethyl-3-piperidinyl)methyl]-3H-indol-3-one?
The molecular weight of 2-[(1,2-Dimethyl-3-piperidinyl)methyl]-3H-indol-3-one is 256.16 g/mol.
Where can I buy 2-[(1,2-Dimethyl-3-piperidinyl)methyl]-3H-indol-3-one?
You can request a quote for 2-[(1,2-Dimethyl-3-piperidinyl)methyl]-3H-indol-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(1,2-Dimethyl-3-piperidinyl)methyl]-3H-indol-3-one?
Yes, KEHONG BIO provides custom synthesis services for 2-[(1,2-Dimethyl-3-piperidinyl)methyl]-3H-indol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.