TL;DR: N-(1-isobutyryl-1,2,3,4-tetrahydroquinolin-7-yl)-2-methylbenzamide (CAS 1005301-12-1) is a chemical compound with molecular formula C21H24N2O2 and molecular weight 336.18378 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methyl-N-[1-(2-methylpropanoyl)-3,4-dihydro-2H-quinolin-7-yl]benzamide
Also Known As: F2049-0309, N-(1-isobutyryl-1,2,3,4-tetrahydroquinolin-7-yl)-2-methylbenzamide, 2-methyl-N-[1-(2-methylpropanoyl)-1,2,3,4-tetrahydroquinolin-7-yl]benzamide, 2-methyl-N-[1-(2-methylpropanoyl)-3,4-dihydro-2H-quinolin-7-yl]benzamide
| Molecular Formula | C21H24N2O2 |
| Molecular Weight | 336.18378 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 336.18378 Da |
| Heavy Atoms | 25 |
| Complexity | 490.0 |
| SMILES | CC1=CC=CC=C1C(=O)NC2=CC3=C(CCCN3C(=O)C(C)C)C=C2 |
| InChIKey | XULFPYBWTBFUMQ-UHFFFAOYSA-N |
The XLogP value of 3.9 indicates that N-(1-isobutyryl-1,2,3,4-tetrahydroquinolin-7-yl)-2-methylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.4 Ų, N-(1-isobutyryl-1,2,3,4-tetrahydroquinolin-7-yl)-2-methylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1-isobutyryl-1,2,3,4-tetrahydroquinolin-7-yl)-2-methylbenzamide has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-(1-isobutyryl-1,2,3,4-tetrahydroquinolin-7-yl)-2-methylbenzamide is 1005301-12-1.
The molecular formula of N-(1-isobutyryl-1,2,3,4-tetrahydroquinolin-7-yl)-2-methylbenzamide is C21H24N2O2.
The molecular weight of N-(1-isobutyryl-1,2,3,4-tetrahydroquinolin-7-yl)-2-methylbenzamide is 336.18378 g/mol.
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