2-(Dimethylamino)-2-methylbutanenitrile
TL;DR: 2-(Dimethylamino)-2-methylbutanenitrile (CAS 44771-65-5) is a chemical compound with molecular formula C7H14N2 and molecular weight 126.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(dimethylamino)-2-methylbutanenitrile
Also Known As: 2-(dimethylamino)-2-methylbutanenitrile, 2-dimethylamino-2-methyl-butanenitrile, Butanenitrile, 2-(dimethylamino)-2-methyl-
| Molecular Formula | C7H14N2 |
|---|---|
| Molecular Weight | 126.12 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 27.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 126.1157 |
| Heavy Atoms | 9 |
| Complexity | 131.0 |
Chemical Identifiers
| CAS Number | 44771-65-5 |
|---|---|
| SMILES | CCC(C)(C#N)N(C)C |
| InChIKey | KSLIXRLNYMURGG-UHFFFAOYSA-N |
Product Overview
2-(Dimethylamino)-2-methylbutanenitrile (CAS 44771-65-5), with molecular formula C7H14N2 and molecular weight 126.12 g/mol. IUPAC: 2-(dimethylamino)-2-methylbutanenitrile.
Chemical Property Profile of 2-(Dimethylamino)-2-methylbutanenitrile
Property Insights of 2-(Dimethylamino)-2-methylbutanenitrile
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Dimethylamino)-2-methylbutanenitrile. With a topological polar surface area (TPSA) of 27.0 Ų, 2-(Dimethylamino)-2-methylbutanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Dimethylamino)-2-methylbutanenitrile has 0 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 2-(Dimethylamino)-2-methylbutanenitrile?
The CAS number of 2-(Dimethylamino)-2-methylbutanenitrile is 44771-65-5.
What is the molecular formula of 2-(Dimethylamino)-2-methylbutanenitrile?
The molecular formula of 2-(Dimethylamino)-2-methylbutanenitrile is C7H14N2.
What is the molecular weight of 2-(Dimethylamino)-2-methylbutanenitrile?
The molecular weight of 2-(Dimethylamino)-2-methylbutanenitrile is 126.12 g/mol.
Where can I buy 2-(Dimethylamino)-2-methylbutanenitrile?
You can request a quote for 2-(Dimethylamino)-2-methylbutanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Dimethylamino)-2-methylbutanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(Dimethylamino)-2-methylbutanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.