4-Oxo-2-(piperidin-1-yl)-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile
TL;DR: 4-Oxo-2-(piperidin-1-yl)-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile (CAS 726199-19-5) is a chemical compound with molecular formula C15H22N4O and molecular weight 274.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxo-2-piperidin-1-yl-1,3-diazaspiro[5.5]undec-1-ene-5-carbonitrile
Also Known As: BAS 10853030, 4-oxo-2-(piperidin-1-yl)-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile, A3816/0162022, 4-oxo-2-(1-piperidinyl)-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile, 4-Oxo-2-piperidin-1-yl-1,3-diaza-spiro[5.5]undec-2-ene-5-carbonitrile
| Molecular Formula | C15H22N4O |
|---|---|
| Molecular Weight | 274.18 g/mol |
| LogP | 1.80078 |
| Topological Polar Surface Area | 68.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 274.17935 |
| Heavy Atoms | 20 |
| Complexity | 452.9842 |
Chemical Identifiers
| CAS Number | 726199-19-5 |
|---|---|
| SMILES | C1CCC2(CC1)C(C(=O)NC(=N2)N3CCCCC3)C#N |
Product Overview
4-Oxo-2-(piperidin-1-yl)-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile (CAS 726199-19-5), with molecular formula C15H22N4O and molecular weight 274.18 g/mol. IUPAC: 4-oxo-2-piperidin-1-yl-1,3-diazaspiro[5.5]undec-1-ene-5-carbonitrile.
Chemical Property Profile of 4-Oxo-2-(piperidin-1-yl)-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile
Property Insights of 4-Oxo-2-(piperidin-1-yl)-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile
The XLogP value of 1.80078 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Oxo-2-(piperidin-1-yl)-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile. The TPSA of 68.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Oxo-2-(piperidin-1-yl)-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile. Following Lipinski's Rule of Five, 4-Oxo-2-(piperidin-1-yl)-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile 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 4-Oxo-2-(piperidin-1-yl)-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile?
The CAS number of 4-Oxo-2-(piperidin-1-yl)-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile is 726199-19-5.
What is the molecular formula of 4-Oxo-2-(piperidin-1-yl)-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile?
The molecular formula of 4-Oxo-2-(piperidin-1-yl)-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile is C15H22N4O.
What is the molecular weight of 4-Oxo-2-(piperidin-1-yl)-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile?
The molecular weight of 4-Oxo-2-(piperidin-1-yl)-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile is 274.18 g/mol.
Where can I buy 4-Oxo-2-(piperidin-1-yl)-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile?
You can request a quote for 4-Oxo-2-(piperidin-1-yl)-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Oxo-2-(piperidin-1-yl)-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-Oxo-2-(piperidin-1-yl)-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.