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

C14H23N3O2 — CID 79150504

IUPAC3-[[2-(ethylaminomethyl)-6-methyl-3-pyridinyl]oxy]-N,N-dimethylpropanamide
SMILESCCNCc1nc(C)ccc1OCCC(=O)N(C)C
InChIInChI=1S/C14H23N3O2/c1-5-15-10-12-13(7-6-11(2)16-12)19-9-8-14(18)17(3)4/h6-7,15H,5,8-10H2,1-4H3
InChIKeyIHXRWXDOOXRNQO-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.36
Rot. Bonds7

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

3-[[2-(ethylaminomethyl)-6-methyl-3-pyridinyl]oxy]-N,N-dimethylpropanamide (PubChem CID 79150504) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 3-[[2-(ethylaminomethyl)-6-methyl-3-pyridinyl]oxy]-N,N-dimethylpropanamide.

Molecular Properties

Compound Name3-[[2-(ethylaminomethyl)-6-methyl-3-pyridinyl]oxy]-N,N-dimethylpropanamide
PubChem CID79150504
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name3-[[2-(ethylaminomethyl)-6-methyl-3-pyridinyl]oxy]-N,N-dimethylpropanamide
SMILESCCNCc1nc(C)ccc1OCCC(=O)N(C)C
InChIInChI=1S/C14H23N3O2/c1-5-15-10-12-13(7-6-11(2)16-12)19-9-8-14(18)17(3)4/h6-7,15H,5,8-10H2,1-4H3
InChIKeyIHXRWXDOOXRNQO-UHFFFAOYSA-N
XLogP1.36
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[2-[(cyclopropylamino)methyl]-6-methyl-3-pyridinyl]oxy]-N,N-dimethylbutanamide
CID 79158444
ethyl 2-[[2-(ethylaminomethyl)-6-methyl-3-pyridinyl]oxy]acetate
CID 79151521
3-[(2-amino-6-methyl-3-pyridinyl)oxy]-N,N-dimethylpropanamide
CID 62098307
N-[(3-but-3-enoxy-6-methyl-2-pyridinyl)methyl]ethanamine
CID 79151520
N-[[6-methyl-3-(3-phenylpropoxy)-2-pyridinyl]methyl]ethanamine
CID 79157323
3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]propanoic acid
CID 103174229
2-[[2-(ethylaminomethyl)-6-methyl-3-pyridinyl]oxy]-N-propan-2-ylacetamide
CID 79150987
methyl 3-[[2-(2-aminoethyl)-6-methyl-3-pyridinyl]oxy]propanoate
CID 79168742
N-[[6-methyl-3-(3-pyrrolidin-1-ylpropoxy)-2-pyridinyl]methyl]ethanamine
CID 79151286
4-[[2-(ethylaminomethyl)-6-methyl-3-pyridinyl]oxy]-2,2-dimethylbutanenitrile
CID 79151514
N-[[6-methyl-3-(pyrimidin-2-ylmethoxy)-2-pyridinyl]methyl]ethanamine
CID 79150991
4-[(2-amino-6-methyl-3-pyridinyl)oxy]-N,N-dimethylbutanamide
CID 62100009

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(ethylaminomethyl)-6-methyl-3-pyridinyl]oxy]-N,N-dimethylpropanamide?
The IUPAC name of 3-[[2-(ethylaminomethyl)-6-methyl-3-pyridinyl]oxy]-N,N-dimethylpropanamide (CID 79150504) is 3-[[2-(ethylaminomethyl)-6-methyl-3-pyridinyl]oxy]-N,N-dimethylpropanamide.
What is the SMILES notation for 3-[[2-(ethylaminomethyl)-6-methyl-3-pyridinyl]oxy]-N,N-dimethylpropanamide?
The canonical SMILES for 3-[[2-(ethylaminomethyl)-6-methyl-3-pyridinyl]oxy]-N,N-dimethylpropanamide is CCNCc1nc(C)ccc1OCCC(=O)N(C)C.
What is the InChIKey of 3-[[2-(ethylaminomethyl)-6-methyl-3-pyridinyl]oxy]-N,N-dimethylpropanamide?
The InChIKey is IHXRWXDOOXRNQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-5-15-10-12-13(7-6-11(2)16-12)19-9-8-14(18)17(3)4/h6-7,15H,5,8-10H2,1-4H3.
What are the key properties of 3-[[2-(ethylaminomethyl)-6-methyl-3-pyridinyl]oxy]-N,N-dimethylpropanamide?
3-[[2-(ethylaminomethyl)-6-methyl-3-pyridinyl]oxy]-N,N-dimethylpropanamide has a molecular weight of 265.36 g/mol, XLogP of 1.36, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(ethylaminomethyl)-6-methyl-3-pyridinyl]oxy]-N,N-dimethylpropanamide is sourced from PubChem (CID 79150504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).