TL;DR: Benzenamine, N-3-butenyl-N-methyl- (CAS 13424-22-1) is a chemical compound with molecular formula C11H15N and molecular weight 161.12045 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-but-3-enyl-N-methylaniline
Also Known As: N-but-3-enyl-N-methylaniline, N-but-3-enyl--N-methylaniline, N-(3-Butenyl)-N-methylaniline, N-Methyl-N-(3-butenyl)aniline, 4-(N-methyl-N-phenylamino)-1-butene
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C11H15N |
| Molecular Weight | 161.12045 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 161.12045 Da |
| Heavy Atoms | 12 |
| Complexity | 125.0 |
| SMILES | CN(CCC=C)C1=CC=CC=C1 |
| InChIKey | IJXNQDFPOFWCKI-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that Benzenamine, N-3-butenyl-N-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, Benzenamine, N-3-butenyl-N-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenamine, N-3-butenyl-N-methyl- 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 Benzenamine, N-3-butenyl-N-methyl- is 13424-22-1.
The molecular formula of Benzenamine, N-3-butenyl-N-methyl- is C11H15N.
The molecular weight of Benzenamine, N-3-butenyl-N-methyl- is 161.12045 g/mol.
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