3-(2-methoxyethoxy)-N-methyl-1-(6-methyl-3-pyridinyl)propan-1-amine

C13H22N2O2 — CID 102928103

IUPAC3-(2-methoxyethoxy)-N-methyl-1-(6-methyl-3-pyridinyl)propan-1-amine
SMILESCNC(CCOCCOC)c1ccc(C)nc1
InChIInChI=1S/C13H22N2O2/c1-11-4-5-12(10-15-11)13(14-2)6-7-17-9-8-16-3/h4-5,10,13-14H,6-9H2,1-3H3
InChIKeyXDYOZDISERNRPM-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.70
Rot. Bonds8

About 3-(2-methoxyethoxy)-N-methyl-1-(6-methyl-3-pyridinyl)propan-1-amine

3-(2-methoxyethoxy)-N-methyl-1-(6-methyl-3-pyridinyl)propan-1-amine (PubChem CID 102928103) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 3-(2-methoxyethoxy)-N-methyl-1-(6-methyl-3-pyridinyl)propan-1-amine.

Molecular Properties

Compound Name3-(2-methoxyethoxy)-N-methyl-1-(6-methyl-3-pyridinyl)propan-1-amine
PubChem CID102928103
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name3-(2-methoxyethoxy)-N-methyl-1-(6-methyl-3-pyridinyl)propan-1-amine
SMILESCNC(CCOCCOC)c1ccc(C)nc1
InChIInChI=1S/C13H22N2O2/c1-11-4-5-12(10-15-11)13(14-2)6-7-17-9-8-16-3/h4-5,10,13-14H,6-9H2,1-3H3
InChIKeyXDYOZDISERNRPM-UHFFFAOYSA-N
XLogP1.70
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[3-(2-methoxyethoxy)-1-(6-methyl-3-pyridinyl)propyl]hydrazine
CID 102929761
3-(2-methoxyethoxy)-1-(6-methyl-3-pyridinyl)propan-1-amine
CID 102927840
1-(4-ethoxyphenyl)-3-(2-methoxyethoxy)-N-methylpropan-1-amine
CID 102928029
3-methoxy-1-(6-methyl-3-pyridinyl)-N-propylpropan-1-amine
CID 63155921
N-methyl-1-(6-methyl-3-pyridinyl)-2-propoxyethanamine
CID 63155924
3-methoxy-N,3-dimethyl-1-(6-methyl-3-pyridinyl)butan-1-amine
CID 103027120
N-methyl-1-(6-methyl-3-pyridinyl)nonan-1-amine
CID 115854494
N-methyl-1-(6-methyl-3-pyridinyl)hex-5-en-1-amine
CID 105153170
N-methyl-1-(6-methyl-3-pyridinyl)-2-(2,2,2-trifluoroethoxy)ethanamine
CID 103215250
N-methyl-1-(6-methyl-3-pyridinyl)oct-7-en-1-amine
CID 107011868
2-(3,5-dimethylphenyl)-N-methyl-1-(6-methyl-3-pyridinyl)ethanamine
CID 63155527
N-methyl-3-(1-methylimidazol-2-yl)-1-(6-methyl-3-pyridinyl)propan-1-amine
CID 105187738

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethoxy)-N-methyl-1-(6-methyl-3-pyridinyl)propan-1-amine?
The IUPAC name of 3-(2-methoxyethoxy)-N-methyl-1-(6-methyl-3-pyridinyl)propan-1-amine (CID 102928103) is 3-(2-methoxyethoxy)-N-methyl-1-(6-methyl-3-pyridinyl)propan-1-amine.
What is the SMILES notation for 3-(2-methoxyethoxy)-N-methyl-1-(6-methyl-3-pyridinyl)propan-1-amine?
The canonical SMILES for 3-(2-methoxyethoxy)-N-methyl-1-(6-methyl-3-pyridinyl)propan-1-amine is CNC(CCOCCOC)c1ccc(C)nc1.
What is the InChIKey of 3-(2-methoxyethoxy)-N-methyl-1-(6-methyl-3-pyridinyl)propan-1-amine?
The InChIKey is XDYOZDISERNRPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-11-4-5-12(10-15-11)13(14-2)6-7-17-9-8-16-3/h4-5,10,13-14H,6-9H2,1-3H3.
What are the key properties of 3-(2-methoxyethoxy)-N-methyl-1-(6-methyl-3-pyridinyl)propan-1-amine?
3-(2-methoxyethoxy)-N-methyl-1-(6-methyl-3-pyridinyl)propan-1-amine has a molecular weight of 238.33 g/mol, XLogP of 1.70, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethoxy)-N-methyl-1-(6-methyl-3-pyridinyl)propan-1-amine is sourced from PubChem (CID 102928103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).