TL;DR: 3-(3-Morpholinopropylamino)propanenitrile (CAS 102440-39-1) is a chemical compound with molecular formula C10H19N3O and molecular weight 197.15282 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3-morpholin-4-ylpropylamino)propanenitrile
Also Known As: 3-(3-morpholinopropylamino)propanenitrile, 3-[(3-MORPHOLINOPROPYL)AMINO]PROPANENITRILE, 3-(3-morpholin-4-ylpropylamino)propanenitrile, 3-((3-morpholinopropyl)amino)propanenitrile, 3-{[3-(morpholin-4-yl)propyl]amino}propanenitrile
| Molecular Formula | C10H19N3O |
| Molecular Weight | 197.15282 g/mol |
| XLogP | -0.5 |
| Topological Polar Surface Area (TPSA) | 48.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 197.15282 Da |
| Heavy Atoms | 14 |
| Complexity | 181.0 |
| SMILES | C1COCCN1CCCNCCC#N |
| InChIKey | DLHVNVSLZVDSRJ-UHFFFAOYSA-N |
The XLogP value of -0.5 indicates that 3-(3-Morpholinopropylamino)propanenitrile is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 48.3 Ų, 3-(3-Morpholinopropylamino)propanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-Morpholinopropylamino)propanenitrile has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-(3-Morpholinopropylamino)propanenitrile is 102440-39-1.
The molecular formula of 3-(3-Morpholinopropylamino)propanenitrile is C10H19N3O.
The molecular weight of 3-(3-Morpholinopropylamino)propanenitrile is 197.15282 g/mol.
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