![Propanenitrile, 3-[[3-(hexahydro-2-oxo-1H-azepin-1-yl)propyl]amino]- structure](/static/products/673/67370-63-2.png)
Propanenitrile, 3-[[3-(hexahydro-2-oxo-1H-azepin-1-yl)propyl]amino]-
TL;DR: Propanenitrile, 3-[[3-(hexahydro-2-oxo-1H-azepin-1-yl)propyl]amino]- (CAS 67370-63-2) is a chemical compound with molecular formula C12H21N3O and molecular weight 223.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(2-oxoazepan-1-yl)propylamino]propanenitrile
Also Known As: 3-[[3- propyl]amino]propanenitrile, N-(6-Cyano-4-azahexyl)-.epsilon.-caprolactam, 3-[3-(2-oxoazepan-1-yl)propylamino]propanenitrile, 3-{[3-(2-oxoazepan-1-yl)propyl]amino}propanenitrile, Propanenitrile, 3-[[3-(hexahydro-2-oxo-1H-azepin-1-yl)propyl]amino]-
| Molecular Formula | C12H21N3O |
|---|---|
| Molecular Weight | 223.17 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 56.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 223.16846 |
| Heavy Atoms | 16 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 67370-63-2 |
|---|---|
| SMILES | C1CCC(=O)N(CC1)CCCNCCC#N |
| InChIKey | VWQURGLLEXLMCX-UHFFFAOYSA-N |
Product Overview
Propanenitrile, 3-[[3-(hexahydro-2-oxo-1H-azepin-1-yl)propyl]amino]- (CAS 67370-63-2), with molecular formula C12H21N3O and molecular weight 223.17 g/mol. IUPAC: 3-[3-(2-oxoazepan-1-yl)propylamino]propanenitrile.
Chemical Property Profile of Propanenitrile, 3-[[3-(hexahydro-2-oxo-1H-azepin-1-yl)propyl]amino]-
Property Insights of Propanenitrile, 3-[[3-(hexahydro-2-oxo-1H-azepin-1-yl)propyl]amino]-
The XLogP value of -0.1 indicates that Propanenitrile, 3-[[3-(hexahydro-2-oxo-1H-azepin-1-yl)propyl]amino]- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 56.1 Ų, Propanenitrile, 3-[[3-(hexahydro-2-oxo-1H-azepin-1-yl)propyl]amino]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propanenitrile, 3-[[3-(hexahydro-2-oxo-1H-azepin-1-yl)propyl]amino]- has 1 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 Propanenitrile, 3-[[3-(hexahydro-2-oxo-1H-azepin-1-yl)propyl]amino]-?
The CAS number of Propanenitrile, 3-[[3-(hexahydro-2-oxo-1H-azepin-1-yl)propyl]amino]- is 67370-63-2.
What is the molecular formula of Propanenitrile, 3-[[3-(hexahydro-2-oxo-1H-azepin-1-yl)propyl]amino]-?
The molecular formula of Propanenitrile, 3-[[3-(hexahydro-2-oxo-1H-azepin-1-yl)propyl]amino]- is C12H21N3O.
What is the molecular weight of Propanenitrile, 3-[[3-(hexahydro-2-oxo-1H-azepin-1-yl)propyl]amino]-?
The molecular weight of Propanenitrile, 3-[[3-(hexahydro-2-oxo-1H-azepin-1-yl)propyl]amino]- is 223.17 g/mol.
Where can I buy Propanenitrile, 3-[[3-(hexahydro-2-oxo-1H-azepin-1-yl)propyl]amino]-?
You can request a quote for Propanenitrile, 3-[[3-(hexahydro-2-oxo-1H-azepin-1-yl)propyl]amino]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanenitrile, 3-[[3-(hexahydro-2-oxo-1H-azepin-1-yl)propyl]amino]-?
Yes, KEHONG BIO provides custom synthesis services for Propanenitrile, 3-[[3-(hexahydro-2-oxo-1H-azepin-1-yl)propyl]amino]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.