1-(Isobutylamino)-3-phenylpropan-2-ol
TL;DR: 1-(Isobutylamino)-3-phenylpropan-2-ol (CAS 285124-32-5) is a chemical compound with molecular formula C13H21NO and molecular weight 207.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-methylpropylamino)-3-phenylpropan-2-ol
Also Known As: 1-(Isobutylamino)-3-phenylpropan-2-ol, N-(3-phenyl-2-hydroxypropyl)N-isobutylamine, 1-(2-methylpropylamino)-3-phenylpropan-2-ol
| Molecular Formula | C13H21NO |
|---|---|
| Molecular Weight | 207.16 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 207.16231 |
| Heavy Atoms | 15 |
| Complexity | 153.0 |
Chemical Identifiers
| CAS Number | 285124-32-5 |
|---|---|
| SMILES | CC(C)CNCC(CC1=CC=CC=C1)O |
| InChIKey | SBBNAFRSDCJWNS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(Isobutylamino)-3-phenylpropan-2-ol (CAS 285124-32-5), with molecular formula C13H21NO and molecular weight 207.16 g/mol. IUPAC: 1-(2-methylpropylamino)-3-phenylpropan-2-ol.
Chemical Property Profile of 1-(Isobutylamino)-3-phenylpropan-2-ol
Property Insights of 1-(Isobutylamino)-3-phenylpropan-2-ol
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Isobutylamino)-3-phenylpropan-2-ol. With a topological polar surface area (TPSA) of 32.3 Ų, 1-(Isobutylamino)-3-phenylpropan-2-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Isobutylamino)-3-phenylpropan-2-ol has 2 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 1-(Isobutylamino)-3-phenylpropan-2-ol?
The CAS number of 1-(Isobutylamino)-3-phenylpropan-2-ol is 285124-32-5.
What is the molecular formula of 1-(Isobutylamino)-3-phenylpropan-2-ol?
The molecular formula of 1-(Isobutylamino)-3-phenylpropan-2-ol is C13H21NO.
What is the molecular weight of 1-(Isobutylamino)-3-phenylpropan-2-ol?
The molecular weight of 1-(Isobutylamino)-3-phenylpropan-2-ol is 207.16 g/mol.
Where can I buy 1-(Isobutylamino)-3-phenylpropan-2-ol?
You can request a quote for 1-(Isobutylamino)-3-phenylpropan-2-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Isobutylamino)-3-phenylpropan-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 1-(Isobutylamino)-3-phenylpropan-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.