RefChem:580562
TL;DR: RefChem:580562 (CAS 68482-78-0) is a chemical compound with molecular formula C16H30N2 and molecular weight 250.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[1,3,3-trimethyl-5-(propan-2-ylideneamino)cyclohexyl]methyl]propan-2-imine
Also Known As: N,N'-Diisopropylideneisophoronediamine, N,N'-Diisopropylidene isophorone diamine, Cyclohexanemethanamine, 1,3,3-trimethyl-N-(1-methylethylidene)-5-((1-methylethylidene)amino)-, Cyclohexanemethanamine, 1,3,3-trimethyl-N-(1-methylethylidene)-5-[(1-methylethylidene)amino]-, n-isopropylidene-3-[(isopropylideneamino)methyl]-3,5,5-trimethylcyclohexanamine
| Molecular Formula | C16H30N2 |
|---|---|
| Molecular Weight | 250.24 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 24.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 250.2409 |
| Heavy Atoms | 18 |
| Complexity | 344.0 |
Chemical Identifiers
| CAS Number | 68482-78-0 |
|---|---|
| SMILES | CC(=NCC1(CC(CC(C1)(C)C)N=C(C)C)C)C |
| InChIKey | CQPAWBDJYIEKOZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:580562 (CAS 68482-78-0), with molecular formula C16H30N2 and molecular weight 250.24 g/mol. IUPAC: N-[[1,3,3-trimethyl-5-(propan-2-ylideneamino)cyclohexyl]methyl]propan-2-imine.
Chemical Property Profile of RefChem:580562
Property Insights of RefChem:580562
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:580562. With a topological polar surface area (TPSA) of 24.7 Ų, RefChem:580562 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:580562 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 RefChem:580562?
The CAS number of RefChem:580562 is 68482-78-0.
What is the molecular formula of RefChem:580562?
The molecular formula of RefChem:580562 is C16H30N2.
What is the molecular weight of RefChem:580562?
The molecular weight of RefChem:580562 is 250.24 g/mol.
Where can I buy RefChem:580562?
You can request a quote for RefChem:580562 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:580562?
Yes, KEHONG BIO provides custom synthesis services for RefChem:580562 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.