3-(3-hydroxypropylamino)-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
TL;DR: 3-(3-hydroxypropylamino)-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile (CAS 903184-70-3) is a chemical compound with molecular formula C14H19N3O and molecular weight 245.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-hydroxypropylamino)-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Also Known As: 3-(3-hydroxypropylamino)-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile, 3-((3-hydroxypropyl)amino)-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile, 3-[(3-hydroxypropyl)amino]-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
| Molecular Formula | C14H19N3O |
|---|---|
| Molecular Weight | 245.15 g/mol |
| LogP | 1.9348 |
| Topological Polar Surface Area | 68.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 245.15282 |
| Heavy Atoms | 18 |
| Complexity | 476.90793 |
Chemical Identifiers
| CAS Number | 903184-70-3 |
|---|---|
| SMILES | CC1=C2CCCCC2=C(C(=N1)NCCCO)C#N |
Product Overview
3-(3-hydroxypropylamino)-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile (CAS 903184-70-3), with molecular formula C14H19N3O and molecular weight 245.15 g/mol. IUPAC: 3-(3-hydroxypropylamino)-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile.
Chemical Property Profile of 3-(3-hydroxypropylamino)-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Property Insights of 3-(3-hydroxypropylamino)-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
The XLogP value of 1.9348 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-hydroxypropylamino)-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile. The TPSA of 68.94 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3-hydroxypropylamino)-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile. Following Lipinski's Rule of Five, 3-(3-hydroxypropylamino)-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(3-hydroxypropylamino)-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile?
The CAS number of 3-(3-hydroxypropylamino)-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile is 903184-70-3.
What is the molecular formula of 3-(3-hydroxypropylamino)-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile?
The molecular formula of 3-(3-hydroxypropylamino)-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile is C14H19N3O.
What is the molecular weight of 3-(3-hydroxypropylamino)-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile?
The molecular weight of 3-(3-hydroxypropylamino)-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile is 245.15 g/mol.
Where can I buy 3-(3-hydroxypropylamino)-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile?
You can request a quote for 3-(3-hydroxypropylamino)-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-hydroxypropylamino)-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-hydroxypropylamino)-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.