TL;DR: 3-(Diphenylphosphino)-N,N-dimethyl-1-propanamine (CAS 961-04-6) is a chemical compound with molecular formula C17H22NP and molecular weight 271.149 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-diphenylphosphanyl-N,N-dimethylpropan-1-amine
Also Known As: 3-Dimethylaminopropyldiphenylphosphine, N,N-Dimethyl-3-(diphenylphosphinyl)-1-propylamine, 1-Propanamine, 3-(diphenylphosphino)-N,N-dimethyl-, 3-(Dimethylamino)propyldiphenylphosphine, 3-diphenylphosphanyl-N,N-dimethylpropan-1-amine
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C17H22NP |
| Molecular Weight | 271.149 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 271.149 Da |
| Heavy Atoms | 19 |
| Complexity | 211.0 |
| SMILES | CN(C)CCCP(C1=CC=CC=C1)C2=CC=CC=C2 |
| InChIKey | AFIXXRLDBNCOPA-UHFFFAOYSA-N |
The XLogP value of 3.4 indicates that 3-(Diphenylphosphino)-N,N-dimethyl-1-propanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, 3-(Diphenylphosphino)-N,N-dimethyl-1-propanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Diphenylphosphino)-N,N-dimethyl-1-propanamine has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-(Diphenylphosphino)-N,N-dimethyl-1-propanamine is 961-04-6.
The molecular formula of 3-(Diphenylphosphino)-N,N-dimethyl-1-propanamine is C17H22NP.
The molecular weight of 3-(Diphenylphosphino)-N,N-dimethyl-1-propanamine is 271.149 g/mol.
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