N-[[5-chloro-6-(2-methoxyethoxy)-3-pyridinyl]methyl]ethanamine

C11H17ClN2O2 — CID 62290358

IUPACN-[[5-chloro-6-(2-methoxyethoxy)-3-pyridinyl]methyl]ethanamine
SMILESCCNCc1cnc(OCCOC)c(Cl)c1
InChIInChI=1S/C11H17ClN2O2/c1-3-13-7-9-6-10(12)11(14-8-9)16-5-4-15-2/h6,8,13H,3-5,7H2,1-2H3
InChIKeyFEWBWZZIHHTFAE-UHFFFAOYSA-N
MW244.72 g/mol
LogP1.87
Rot. Bonds7

About N-[[5-chloro-6-(2-methoxyethoxy)-3-pyridinyl]methyl]ethanamine

N-[[5-chloro-6-(2-methoxyethoxy)-3-pyridinyl]methyl]ethanamine (PubChem CID 62290358) has the molecular formula C11H17ClN2O2 and a molecular weight of 244.72 g/mol. Its IUPAC name is N-[[5-chloro-6-(2-methoxyethoxy)-3-pyridinyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[5-chloro-6-(2-methoxyethoxy)-3-pyridinyl]methyl]ethanamine
PubChem CID62290358
Molecular FormulaC11H17ClN2O2
Molecular Weight244.72 g/mol
Exact Mass244.10
IUPAC NameN-[[5-chloro-6-(2-methoxyethoxy)-3-pyridinyl]methyl]ethanamine
SMILESCCNCc1cnc(OCCOC)c(Cl)c1
InChIInChI=1S/C11H17ClN2O2/c1-3-13-7-9-6-10(12)11(14-8-9)16-5-4-15-2/h6,8,13H,3-5,7H2,1-2H3
InChIKeyFEWBWZZIHHTFAE-UHFFFAOYSA-N
XLogP1.87
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.72
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[[5-chloro-6-(2-methoxyethoxy)-3-pyridinyl]methyl]ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(5-chloro-6-pent-4-enoxy-3-pyridinyl)methyl]ethanamine
CID 79114404
3-[[3-chloro-5-(ethylaminomethyl)-2-pyridinyl]oxy]-N,N-dimethylpropan-1-amine
CID 62298233
N-[[5-chloro-6-[3-(2-methoxyethoxy)propoxy]-3-pyridinyl]methyl]propan-1-amine
CID 103405941
3-chloro-N-ethyl-5-(ethylaminomethyl)-N-(2-methoxyethyl)pyridin-2-amine
CID 62295498
N-[[5-chloro-6-(2-thiophen-2-ylethoxy)-3-pyridinyl]methyl]ethanamine
CID 62323331
N-[[5-chloro-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]-3-pyridinyl]methyl]ethanamine
CID 62291236
3-chloro-5-(ethylaminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-2-amine
CID 62295520
N-[(5-chloro-6-cyclobutyloxy-3-pyridinyl)methyl]ethanamine
CID 62286994
N-[[5-chloro-6-(oxetan-3-yloxy)-3-pyridinyl]methyl]ethanamine
CID 102607900
N-[[5-chloro-6-(3-methylbutoxy)-3-pyridinyl]methyl]propan-1-amine
CID 62290699
N-[[5-chloro-6-(2-methylphenoxy)-3-pyridinyl]methyl]ethanamine
CID 55058407
1-(5-chloro-6-pentoxy-3-pyridinyl)-N-methylmethanamine
CID 62296845

Frequently Asked Questions

What is the IUPAC name of N-[[5-chloro-6-(2-methoxyethoxy)-3-pyridinyl]methyl]ethanamine?
The IUPAC name of N-[[5-chloro-6-(2-methoxyethoxy)-3-pyridinyl]methyl]ethanamine (CID 62290358) is N-[[5-chloro-6-(2-methoxyethoxy)-3-pyridinyl]methyl]ethanamine.
What is the SMILES notation for N-[[5-chloro-6-(2-methoxyethoxy)-3-pyridinyl]methyl]ethanamine?
The canonical SMILES for N-[[5-chloro-6-(2-methoxyethoxy)-3-pyridinyl]methyl]ethanamine is CCNCc1cnc(OCCOC)c(Cl)c1.
What is the InChIKey of N-[[5-chloro-6-(2-methoxyethoxy)-3-pyridinyl]methyl]ethanamine?
The InChIKey is FEWBWZZIHHTFAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17ClN2O2/c1-3-13-7-9-6-10(12)11(14-8-9)16-5-4-15-2/h6,8,13H,3-5,7H2,1-2H3.
What are the key properties of N-[[5-chloro-6-(2-methoxyethoxy)-3-pyridinyl]methyl]ethanamine?
N-[[5-chloro-6-(2-methoxyethoxy)-3-pyridinyl]methyl]ethanamine has a molecular weight of 244.72 g/mol, XLogP of 1.87, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-chloro-6-(2-methoxyethoxy)-3-pyridinyl]methyl]ethanamine is sourced from PubChem (CID 62290358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).