TL;DR: Benzenamine, 4-(1-methylpropyl)- (CAS 30273-11-1) is a chemical compound with molecular formula C10H15N and molecular weight 149.12045 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-butan-2-ylaniline
Also Known As: 4-sec-Butylaniline, 4-(sec-butyl)aniline, p-sec-Butylaniline, Benzenamine, 4-(1-methylpropyl)-, 4-butan-2-ylaniline
Top 5 of 17 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H15N |
| Molecular Weight | 149.12045 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 149.12045 Da |
| Heavy Atoms | 11 |
| Complexity | 103.0 |
| SMILES | CCC(C)C1=CC=C(C=C1)N |
| InChIKey | NVVVQTNTLIAISI-UHFFFAOYSA-N |
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenamine, 4-(1-methylpropyl)-. With a topological polar surface area (TPSA) of 26.0 Ų, Benzenamine, 4-(1-methylpropyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenamine, 4-(1-methylpropyl)- has 1 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, 4-(1-methylpropyl)- is 30273-11-1.
The molecular formula of Benzenamine, 4-(1-methylpropyl)- is C10H15N.
The molecular weight of Benzenamine, 4-(1-methylpropyl)- is 149.12045 g/mol.
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