![(2z)-{[4-(Dimethylamino)phenyl]imino}(phenyl)ethanenitrile structure](/static/products/1007/100700-22-9.webp)
(2z)-{[4-(Dimethylamino)phenyl]imino}(phenyl)ethanenitrile
TL;DR: (2z)-{[4-(Dimethylamino)phenyl]imino}(phenyl)ethanenitrile (CAS 100700-22-9) is a chemical compound with molecular formula C16H15N3 and molecular weight 249.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(dimethylamino)phenyl]benzenecarboximidoyl cyanide
Also Known As: 9-Butyramidojulolidine, KST-1A0324, (2z)-{[4-(dimethylamino)phenyl]imino}(phenyl)ethanenitrile, N-[4-(dimethylamino)phenyl]benzenecarboximidoyl cyanide, N'-p-Fluorophenyl-N,N-dimethyl formamidine
| Molecular Formula | C16H15N3 |
|---|---|
| Molecular Weight | 249.13 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 39.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 249.1266 |
| Heavy Atoms | 19 |
| Complexity | 349.0 |
Chemical Identifiers
| CAS Number | 100700-22-9 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)N=C(C#N)C2=CC=CC=C2 |
| InChIKey | CGIGSJWVCYXZFH-UHFFFAOYSA-N |
Product Overview
(2z)-{[4-(Dimethylamino)phenyl]imino}(phenyl)ethanenitrile (CAS 100700-22-9), with molecular formula C16H15N3 and molecular weight 249.13 g/mol. IUPAC: N-[4-(dimethylamino)phenyl]benzenecarboximidoyl cyanide.
Chemical Property Profile of (2z)-{[4-(Dimethylamino)phenyl]imino}(phenyl)ethanenitrile
Property Insights of (2z)-{[4-(Dimethylamino)phenyl]imino}(phenyl)ethanenitrile
The XLogP value of 3.5 indicates that (2z)-{[4-(Dimethylamino)phenyl]imino}(phenyl)ethanenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.4 Ų, (2z)-{[4-(Dimethylamino)phenyl]imino}(phenyl)ethanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2z)-{[4-(Dimethylamino)phenyl]imino}(phenyl)ethanenitrile 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 (2z)-{[4-(Dimethylamino)phenyl]imino}(phenyl)ethanenitrile?
The CAS number of (2z)-{[4-(Dimethylamino)phenyl]imino}(phenyl)ethanenitrile is 100700-22-9.
What is the molecular formula of (2z)-{[4-(Dimethylamino)phenyl]imino}(phenyl)ethanenitrile?
The molecular formula of (2z)-{[4-(Dimethylamino)phenyl]imino}(phenyl)ethanenitrile is C16H15N3.
What is the molecular weight of (2z)-{[4-(Dimethylamino)phenyl]imino}(phenyl)ethanenitrile?
The molecular weight of (2z)-{[4-(Dimethylamino)phenyl]imino}(phenyl)ethanenitrile is 249.13 g/mol.
Where can I buy (2z)-{[4-(Dimethylamino)phenyl]imino}(phenyl)ethanenitrile?
You can request a quote for (2z)-{[4-(Dimethylamino)phenyl]imino}(phenyl)ethanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2z)-{[4-(Dimethylamino)phenyl]imino}(phenyl)ethanenitrile?
Yes, KEHONG BIO provides custom synthesis services for (2z)-{[4-(Dimethylamino)phenyl]imino}(phenyl)ethanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.