N-((5-Phenyl-1,3,4-oxadiazol-2-yl)methyl)propan-1-amine
TL;DR: N-((5-Phenyl-1,3,4-oxadiazol-2-yl)methyl)propan-1-amine (CAS 1185124-33-7) is a chemical compound with molecular formula C12H15N3O and molecular weight 217.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]propan-1-amine
Also Known As: N-((5-Phenyl-1,3,4-oxadiazol-2-yl)methyl)propan-1-amine, N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]propan-1-amine, [(5-PHENYL-1,3,4-OXADIAZOL-2-YL)METHYL](PROPYL)AMINE, (5-Phenyl-[1,3,4]oxadiazol-2-ylmethyl)-propyl-amine, 5-Phenyl-N-propyl-1,3,4-oxadiazole-2-methanamine
| Molecular Formula | C12H15N3O |
|---|---|
| Molecular Weight | 217.12 g/mol |
| LogP | 2.2362 |
| Topological Polar Surface Area | 50.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 217.1215 |
| Heavy Atoms | 16 |
| Complexity | 424.83875 |
Chemical Identifiers
| CAS Number | 1185124-33-7 |
|---|---|
| SMILES | CCCNCC1=NN=C(O1)C2=CC=CC=C2 |
Product Overview
N-((5-Phenyl-1,3,4-oxadiazol-2-yl)methyl)propan-1-amine (CAS 1185124-33-7), with molecular formula C12H15N3O and molecular weight 217.12 g/mol. IUPAC: N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]propan-1-amine.
Chemical Property Profile of N-((5-Phenyl-1,3,4-oxadiazol-2-yl)methyl)propan-1-amine
Property Insights of N-((5-Phenyl-1,3,4-oxadiazol-2-yl)methyl)propan-1-amine
The XLogP value of 2.2362 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-((5-Phenyl-1,3,4-oxadiazol-2-yl)methyl)propan-1-amine. With a topological polar surface area (TPSA) of 50.95 Ų, N-((5-Phenyl-1,3,4-oxadiazol-2-yl)methyl)propan-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-((5-Phenyl-1,3,4-oxadiazol-2-yl)methyl)propan-1-amine has 1 hydrogen bond donor(s) and 4 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 N-((5-Phenyl-1,3,4-oxadiazol-2-yl)methyl)propan-1-amine?
The CAS number of N-((5-Phenyl-1,3,4-oxadiazol-2-yl)methyl)propan-1-amine is 1185124-33-7.
What is the molecular formula of N-((5-Phenyl-1,3,4-oxadiazol-2-yl)methyl)propan-1-amine?
The molecular formula of N-((5-Phenyl-1,3,4-oxadiazol-2-yl)methyl)propan-1-amine is C12H15N3O.
What is the molecular weight of N-((5-Phenyl-1,3,4-oxadiazol-2-yl)methyl)propan-1-amine?
The molecular weight of N-((5-Phenyl-1,3,4-oxadiazol-2-yl)methyl)propan-1-amine is 217.12 g/mol.
Where can I buy N-((5-Phenyl-1,3,4-oxadiazol-2-yl)methyl)propan-1-amine?
You can request a quote for N-((5-Phenyl-1,3,4-oxadiazol-2-yl)methyl)propan-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-((5-Phenyl-1,3,4-oxadiazol-2-yl)methyl)propan-1-amine?
Yes, KEHONG BIO provides custom synthesis services for N-((5-Phenyl-1,3,4-oxadiazol-2-yl)methyl)propan-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.