TL;DR: Indole, 6-nitro-3-(piperidinomethyl)- (CAS 101832-09-1) is a chemical compound with molecular formula C14H17N3O2 and molecular weight 259.13208 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-nitro-3-(piperidin-1-ylmethyl)-1H-indole
Also Known As: 6-nitro-3-(piperidin-1-ylmethyl)-1H-indole, 6-Nitro-3-(piperidinomethyl)indole, INDOLE, 6-NITRO-3-(PIPERIDINOMETHYL)-, 6-nitro-3-[(piperidin-1-yl)methyl]-1H-indole, 6-nitro-3-(1-piperidylmethyl)-1H-indole
| Molecular Formula | C14H17N3O2 |
| Molecular Weight | 259.13208 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 64.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 259.13208 Da |
| Heavy Atoms | 19 |
| Complexity | 325.0 |
| SMILES | C1CCN(CC1)CC2=CNC3=C2C=CC(=C3)[N+](=O)[O-] |
| InChIKey | CGHIJADMYOVGCZ-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Indole, 6-nitro-3-(piperidinomethyl)-. The TPSA of 64.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Indole, 6-nitro-3-(piperidinomethyl)-. Following Lipinski's Rule of Five, Indole, 6-nitro-3-(piperidinomethyl)- has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Indole, 6-nitro-3-(piperidinomethyl)- is 101832-09-1.
The molecular formula of Indole, 6-nitro-3-(piperidinomethyl)- is C14H17N3O2.
The molecular weight of Indole, 6-nitro-3-(piperidinomethyl)- is 259.13208 g/mol.
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