2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N,N-dimethylethanamine

C12H21N3O — CID 79776683

IUPAC2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N,N-dimethylethanamine
SMILESCCNCc1ccc(OCCN(C)C)cn1
InChIInChI=1S/C12H21N3O/c1-4-13-9-11-5-6-12(10-14-11)16-8-7-15(2)3/h5-6,10,13H,4,7-9H2,1-3H3
InChIKeyOMEISZDFJYASKE-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.13
Rot. Bonds7

About 2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N,N-dimethylethanamine

2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N,N-dimethylethanamine (PubChem CID 79776683) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is 2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N,N-dimethylethanamine
PubChem CID79776683
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC Name2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N,N-dimethylethanamine
SMILESCCNCc1ccc(OCCN(C)C)cn1
InChIInChI=1S/C12H21N3O/c1-4-13-9-11-5-6-12(10-14-11)16-8-7-15(2)3/h5-6,10,13H,4,7-9H2,1-3H3
InChIKeyOMEISZDFJYASKE-UHFFFAOYSA-N
XLogP1.13
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[5-(2-fluoroethoxy)-2-pyridinyl]methyl]ethanamine
CID 80700229
N-[(5-ethoxy-2-pyridinyl)methyl]ethanamine
CID 79775704
N-[[5-(2-phenoxyethoxy)-2-pyridinyl]methyl]ethanamine
CID 79775994
4-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]butan-1-ol
CID 79776524
N-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]methyl]propan-1-amine
CID 79782675
N-[[5-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]methyl]ethanamine
CID 79776328
2-[[6-(propylaminomethyl)-3-pyridinyl]oxy]ethanol
CID 79782983
N-[(5-butoxy-2-pyridinyl)methyl]-2-methoxyethanamine
CID 79793851
N-[[5-[(3,5-difluorophenyl)methoxy]-2-pyridinyl]methyl]ethanamine
CID 105402630
N-[[5-(pyridin-3-ylmethoxy)-2-pyridinyl]methyl]ethanamine
CID 79775715
N-[(5-but-3-en-2-yloxy-2-pyridinyl)methyl]ethanamine
CID 79775993
2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-1-pyrrolidin-1-ylethanone
CID 79775446

Frequently Asked Questions

What is the IUPAC name of 2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N,N-dimethylethanamine?
The IUPAC name of 2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N,N-dimethylethanamine (CID 79776683) is 2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N,N-dimethylethanamine.
What is the SMILES notation for 2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N,N-dimethylethanamine?
The canonical SMILES for 2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N,N-dimethylethanamine is CCNCc1ccc(OCCN(C)C)cn1.
What is the InChIKey of 2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N,N-dimethylethanamine?
The InChIKey is OMEISZDFJYASKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-4-13-9-11-5-6-12(10-14-11)16-8-7-15(2)3/h5-6,10,13H,4,7-9H2,1-3H3.
What are the key properties of 2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N,N-dimethylethanamine?
2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N,N-dimethylethanamine has a molecular weight of 223.32 g/mol, XLogP of 1.13, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N,N-dimethylethanamine is sourced from PubChem (CID 79776683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).