InChI=1/C5H14BN/c1-4-6(5-2)7-3/h7H,4-5H2,1-3H
TL;DR: InChI=1/C5H14BN/c1-4-6(5-2)7-3/h7H,4-5H2,1-3H (CAS 7360-68-1) is a chemical compound with molecular formula C5H14BN and molecular weight 99.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-diethylboranylmethanamine
Also Known As: (methylamino)diethylborane, N-diethylboranylmethanamine, InChI=1/C5H14BN/c1-4-6(5-2)7-3/h7H,4-5H2,1-3H
| Molecular Formula | C5H14BN |
|---|---|
| Molecular Weight | 99.12 g/mol |
| LogP | 1.2371 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 99.12193 |
| Heavy Atoms | 7 |
| Complexity | 29.551619 |
Chemical Identifiers
| CAS Number | 7360-68-1 |
|---|---|
| SMILES | B(CC)(CC)NC |
Product Overview
InChI=1/C5H14BN/c1-4-6(5-2)7-3/h7H,4-5H2,1-3H (CAS 7360-68-1), with molecular formula C5H14BN and molecular weight 99.12 g/mol. IUPAC: N-diethylboranylmethanamine.
Chemical Property Profile of InChI=1/C5H14BN/c1-4-6(5-2)7-3/h7H,4-5H2,1-3H
Property Insights of InChI=1/C5H14BN/c1-4-6(5-2)7-3/h7H,4-5H2,1-3H
The XLogP value of 1.2371 suggests moderate lipophilicity, balancing water solubility and membrane permeability for InChI=1/C5H14BN/c1-4-6(5-2)7-3/h7H,4-5H2,1-3H. With a topological polar surface area (TPSA) of 12.03 Ų, InChI=1/C5H14BN/c1-4-6(5-2)7-3/h7H,4-5H2,1-3H exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, InChI=1/C5H14BN/c1-4-6(5-2)7-3/h7H,4-5H2,1-3H has 1 hydrogen bond donor(s) and 1 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 InChI=1/C5H14BN/c1-4-6(5-2)7-3/h7H,4-5H2,1-3H?
The CAS number of InChI=1/C5H14BN/c1-4-6(5-2)7-3/h7H,4-5H2,1-3H is 7360-68-1.
What is the molecular formula of InChI=1/C5H14BN/c1-4-6(5-2)7-3/h7H,4-5H2,1-3H?
The molecular formula of InChI=1/C5H14BN/c1-4-6(5-2)7-3/h7H,4-5H2,1-3H is C5H14BN.
What is the molecular weight of InChI=1/C5H14BN/c1-4-6(5-2)7-3/h7H,4-5H2,1-3H?
The molecular weight of InChI=1/C5H14BN/c1-4-6(5-2)7-3/h7H,4-5H2,1-3H is 99.12 g/mol.
Where can I buy InChI=1/C5H14BN/c1-4-6(5-2)7-3/h7H,4-5H2,1-3H?
You can request a quote for InChI=1/C5H14BN/c1-4-6(5-2)7-3/h7H,4-5H2,1-3H directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for InChI=1/C5H14BN/c1-4-6(5-2)7-3/h7H,4-5H2,1-3H?
Yes, KEHONG BIO provides custom synthesis services for InChI=1/C5H14BN/c1-4-6(5-2)7-3/h7H,4-5H2,1-3H and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.