(3,5-Diaminophenyl)(piperidin-1-yl)methanone
TL;DR: (3,5-Diaminophenyl)(piperidin-1-yl)methanone (CAS 314047-34-2) is a chemical compound with molecular formula C12H17N3O and molecular weight 219.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,5-diaminophenyl)-piperidin-1-ylmethanone
Also Known As: (3,5-diaminophenyl)(piperidin-1-yl)methanone, (3,5-Diamino-phenyl)-piperidin-1-yl-methanone, (3,5-diaminophenyl)-piperidin-1-ylmethanone, 3,5-diaminophenyl piperidyl ketone, BAS 00633936
| Molecular Formula | C12H17N3O |
|---|---|
| Molecular Weight | 219.14 g/mol |
| LogP | 1.4771 |
| Topological Polar Surface Area | 72.35 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 219.13716 |
| Heavy Atoms | 16 |
| Complexity | 377.0004 |
Chemical Identifiers
| CAS Number | 314047-34-2 |
|---|---|
| SMILES | C1CCN(CC1)C(=O)C2=CC(=CC(=C2)N)N |
Product Overview
(3,5-Diaminophenyl)(piperidin-1-yl)methanone (CAS 314047-34-2), with molecular formula C12H17N3O and molecular weight 219.14 g/mol. IUPAC: (3,5-diaminophenyl)-piperidin-1-ylmethanone.
Chemical Property Profile of (3,5-Diaminophenyl)(piperidin-1-yl)methanone
Property Insights of (3,5-Diaminophenyl)(piperidin-1-yl)methanone
The XLogP value of 1.4771 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3,5-Diaminophenyl)(piperidin-1-yl)methanone. The TPSA of 72.35 Ų falls within the moderate polarity range, balancing permeability and solubility for (3,5-Diaminophenyl)(piperidin-1-yl)methanone. Following Lipinski's Rule of Five, (3,5-Diaminophenyl)(piperidin-1-yl)methanone has 2 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 (3,5-Diaminophenyl)(piperidin-1-yl)methanone?
The CAS number of (3,5-Diaminophenyl)(piperidin-1-yl)methanone is 314047-34-2.
What is the molecular formula of (3,5-Diaminophenyl)(piperidin-1-yl)methanone?
The molecular formula of (3,5-Diaminophenyl)(piperidin-1-yl)methanone is C12H17N3O.
What is the molecular weight of (3,5-Diaminophenyl)(piperidin-1-yl)methanone?
The molecular weight of (3,5-Diaminophenyl)(piperidin-1-yl)methanone is 219.14 g/mol.
Where can I buy (3,5-Diaminophenyl)(piperidin-1-yl)methanone?
You can request a quote for (3,5-Diaminophenyl)(piperidin-1-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3,5-Diaminophenyl)(piperidin-1-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (3,5-Diaminophenyl)(piperidin-1-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.