5-(Dimethylamino)-2,2-diphenyl-valeronitrile
TL;DR: 5-(Dimethylamino)-2,2-diphenyl-valeronitrile (CAS 6306-95-2) is a chemical compound with molecular formula C19H22N2 and molecular weight 278.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(dimethylamino)-2,2-diphenylpentanenitrile
Also Known As: 5-(dimethylamino)-2,2-diphenylpentanenitrile, Valeronitrile, 5-(dimethylamino)-2,2-diphenyl-, 5-(Dimethylamino)-2,2-diphenylvaleronitrile, alpha-(3-Dimethylaminopropyl)diphenylacetonitrile, 5-(Dimethylamino)-2,2-diphenyl-valeronitrile
| Molecular Formula | C19H22N2 |
|---|---|
| Molecular Weight | 278.18 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 27.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 278.17828 |
| Heavy Atoms | 21 |
| Complexity | 322.0 |
Chemical Identifiers
| CAS Number | 6306-95-2 |
|---|---|
| SMILES | CN(C)CCCC(C#N)(C1=CC=CC=C1)C2=CC=CC=C2 |
| InChIKey | CUSRNMDZVRKOIM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-(Dimethylamino)-2,2-diphenyl-valeronitrile (CAS 6306-95-2), with molecular formula C19H22N2 and molecular weight 278.18 g/mol. IUPAC: 5-(dimethylamino)-2,2-diphenylpentanenitrile.
Chemical Property Profile of 5-(Dimethylamino)-2,2-diphenyl-valeronitrile
Property Insights of 5-(Dimethylamino)-2,2-diphenyl-valeronitrile
The XLogP value of 3.8 indicates that 5-(Dimethylamino)-2,2-diphenyl-valeronitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.0 Ų, 5-(Dimethylamino)-2,2-diphenyl-valeronitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Dimethylamino)-2,2-diphenyl-valeronitrile 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 5-(Dimethylamino)-2,2-diphenyl-valeronitrile?
The CAS number of 5-(Dimethylamino)-2,2-diphenyl-valeronitrile is 6306-95-2.
What is the molecular formula of 5-(Dimethylamino)-2,2-diphenyl-valeronitrile?
The molecular formula of 5-(Dimethylamino)-2,2-diphenyl-valeronitrile is C19H22N2.
What is the molecular weight of 5-(Dimethylamino)-2,2-diphenyl-valeronitrile?
The molecular weight of 5-(Dimethylamino)-2,2-diphenyl-valeronitrile is 278.18 g/mol.
Where can I buy 5-(Dimethylamino)-2,2-diphenyl-valeronitrile?
You can request a quote for 5-(Dimethylamino)-2,2-diphenyl-valeronitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Dimethylamino)-2,2-diphenyl-valeronitrile?
Yes, KEHONG BIO provides custom synthesis services for 5-(Dimethylamino)-2,2-diphenyl-valeronitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.