2H-Azepin-2-one, 1-(3-aminopropyl)hexahydro-
TL;DR: 2H-Azepin-2-one, 1-(3-aminopropyl)hexahydro- (CAS 24566-95-8) is a chemical compound with molecular formula C9H18N2O and molecular weight 170.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-aminopropyl)azepan-2-one
Also Known As: 1-(3-aminopropyl)azepan-2-one, 2H-Azepin-2-one, 1-(3-aminopropyl)hexahydro-, 1- azepan-2-one, Baricitinib Impurity A, Baricitinib Impurity 16
| Molecular Formula | C9H18N2O |
|---|---|
| Molecular Weight | 170.14 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 46.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 170.1419 |
| Heavy Atoms | 12 |
| Complexity | 147.0 |
Chemical Identifiers
| CAS Number | 24566-95-8 |
|---|---|
| SMILES | C1CCC(=O)N(CC1)CCCN |
| InChIKey | IZYZHQOYVLYGRW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2H-Azepin-2-one, 1-(3-aminopropyl)hexahydro- (CAS 24566-95-8), with molecular formula C9H18N2O and molecular weight 170.14 g/mol. IUPAC: 1-(3-aminopropyl)azepan-2-one.
Chemical Property Profile of 2H-Azepin-2-one, 1-(3-aminopropyl)hexahydro-
Property Insights of 2H-Azepin-2-one, 1-(3-aminopropyl)hexahydro-
The XLogP value of -0.3 indicates that 2H-Azepin-2-one, 1-(3-aminopropyl)hexahydro- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 46.3 Ų, 2H-Azepin-2-one, 1-(3-aminopropyl)hexahydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-Azepin-2-one, 1-(3-aminopropyl)hexahydro- has 1 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 2H-Azepin-2-one, 1-(3-aminopropyl)hexahydro-?
The CAS number of 2H-Azepin-2-one, 1-(3-aminopropyl)hexahydro- is 24566-95-8.
What is the molecular formula of 2H-Azepin-2-one, 1-(3-aminopropyl)hexahydro-?
The molecular formula of 2H-Azepin-2-one, 1-(3-aminopropyl)hexahydro- is C9H18N2O.
What is the molecular weight of 2H-Azepin-2-one, 1-(3-aminopropyl)hexahydro-?
The molecular weight of 2H-Azepin-2-one, 1-(3-aminopropyl)hexahydro- is 170.14 g/mol.
Where can I buy 2H-Azepin-2-one, 1-(3-aminopropyl)hexahydro-?
You can request a quote for 2H-Azepin-2-one, 1-(3-aminopropyl)hexahydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-Azepin-2-one, 1-(3-aminopropyl)hexahydro-?
Yes, KEHONG BIO provides custom synthesis services for 2H-Azepin-2-one, 1-(3-aminopropyl)hexahydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.