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2-[(2-Methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]aniline structure
Fine Chemical

2-[(2-Methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]aniline

TL;DR: 2-[(2-Methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]aniline (CAS 412322-15-7) is a chemical compound with molecular formula C17H20N2 and molecular weight 252.16264 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]aniline

Also Known As: 2-[(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]aniline, 2-[(2-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]aniline, [2-[(2-methyl-1,2,3,4-tetrahydro-isoquinolin-1-yl)-methyl]-phenyl]-amine, 2-((2-Methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl)aniline, 2-[(2-methyl-1,2,3,4-tetrahydro-1-isoquinolinyl)methyl]aniline

CAS Number
412322-15-7
Molecular Formula
C17H20N2
Molecular Weight
252.16264 g/mol
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Technical Specifications

Molecular FormulaC17H20N2
Molecular Weight252.16264 g/mol
XLogP3.1
Topological Polar Surface Area (TPSA)29.3 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors2
Rotatable Bonds2
Exact Mass252.16264 Da
Heavy Atoms19
Complexity291.0
SMILESCN1CCC2=CC=CC=C2C1CC3=CC=CC=C3N
InChIKeyLOUNSLPRJCRBAK-UHFFFAOYSA-N

Chemical Property Profile of 2-[(2-Methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]aniline

XLogP
3.1
TPSA (Topological Polar Surface Area)
29.3
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
Rotatable Bonds
2
Heavy Atoms
19
Complexity
291.0
Exact Mass
252.16264
Monoisotopic Mass
252.16264
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 2-[(2-Methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]aniline

The XLogP value of 3.1 indicates that 2-[(2-Methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.3 Ų, 2-[(2-Methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(2-Methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]aniline has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2-[(2-Methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]aniline?

The CAS number of 2-[(2-Methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]aniline is 412322-15-7.

What is the molecular formula of 2-[(2-Methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]aniline?

The molecular formula of 2-[(2-Methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]aniline is C17H20N2.

What is the molecular weight of 2-[(2-Methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]aniline?

The molecular weight of 2-[(2-Methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]aniline is 252.16264 g/mol.

Where can I buy 2-[(2-Methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]aniline?

You can request a quote for 2-[(2-Methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]aniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-[(2-Methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]aniline?

Yes, CoreyChem provides custom synthesis services for 2-[(2-Methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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