4-(Methylnitrosoamino)-4-(3-pyridyl)-1-butanol
TL;DR: 4-(Methylnitrosoamino)-4-(3-pyridyl)-1-butanol (CAS 59578-66-4) is a chemical compound with molecular formula C10H15N3O2 and molecular weight 209.11642 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(4-hydroxy-1-pyridin-3-ylbutyl)-N-methylnitrous amide
Also Known As: Iso-NNAL, 4-(N-Methyl-N-nitrosamino)-4-(3-pyridyl)butane-1-ol, 4-(Methylnitrosoamino)-4-(3-pyridyl)-1-butanol, delta-(Methylnitrosoamino)-, 4- -4- butane-1-ol
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H15N3O2 |
| Molecular Weight | 209.11642 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 65.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 209.11642 Da |
| Heavy Atoms | 15 |
| Complexity | 190.0 |
| SMILES | CN(C(CCCO)C1=CN=CC=C1)N=O |
| InChIKey | IIDMFFRDEFHWCJ-UHFFFAOYSA-N |
Chemical Property Profile of 4-(Methylnitrosoamino)-4-(3-pyridyl)-1-butanol
Property Insights of 4-(Methylnitrosoamino)-4-(3-pyridyl)-1-butanol
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Methylnitrosoamino)-4-(3-pyridyl)-1-butanol. The TPSA of 65.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Methylnitrosoamino)-4-(3-pyridyl)-1-butanol. Following Lipinski's Rule of Five, 4-(Methylnitrosoamino)-4-(3-pyridyl)-1-butanol has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-(Methylnitrosoamino)-4-(3-pyridyl)-1-butanol?
The CAS number of 4-(Methylnitrosoamino)-4-(3-pyridyl)-1-butanol is 59578-66-4.
What is the molecular formula of 4-(Methylnitrosoamino)-4-(3-pyridyl)-1-butanol?
The molecular formula of 4-(Methylnitrosoamino)-4-(3-pyridyl)-1-butanol is C10H15N3O2.
What is the molecular weight of 4-(Methylnitrosoamino)-4-(3-pyridyl)-1-butanol?
The molecular weight of 4-(Methylnitrosoamino)-4-(3-pyridyl)-1-butanol is 209.11642 g/mol.
Where can I buy 4-(Methylnitrosoamino)-4-(3-pyridyl)-1-butanol?
You can request a quote for 4-(Methylnitrosoamino)-4-(3-pyridyl)-1-butanol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(Methylnitrosoamino)-4-(3-pyridyl)-1-butanol?
Yes, CoreyChem provides custom synthesis services for 4-(Methylnitrosoamino)-4-(3-pyridyl)-1-butanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.