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

C14H23N3O2 — CID 79795923

IUPAC2-[[6-(2-aminobutyl)-3-pyridinyl]oxy]-N,N-dimethylpropanamide
SMILESCCC(N)Cc1ccc(OC(C)C(=O)N(C)C)cn1
InChIInChI=1S/C14H23N3O2/c1-5-11(15)8-12-6-7-13(9-16-12)19-10(2)14(18)17(3)4/h6-7,9-11H,5,8,15H2,1-4H3
InChIKeyWPZZRWSNCGDFLF-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.22
Rot. Bonds6

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

2-[[6-(2-aminobutyl)-3-pyridinyl]oxy]-N,N-dimethylpropanamide (PubChem CID 79795923) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-[[6-(2-aminobutyl)-3-pyridinyl]oxy]-N,N-dimethylpropanamide.

Molecular Properties

Compound Name2-[[6-(2-aminobutyl)-3-pyridinyl]oxy]-N,N-dimethylpropanamide
PubChem CID79795923
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name2-[[6-(2-aminobutyl)-3-pyridinyl]oxy]-N,N-dimethylpropanamide
SMILESCCC(N)Cc1ccc(OC(C)C(=O)N(C)C)cn1
InChIInChI=1S/C14H23N3O2/c1-5-11(15)8-12-6-7-13(9-16-12)19-10(2)14(18)17(3)4/h6-7,9-11H,5,8,15H2,1-4H3
InChIKeyWPZZRWSNCGDFLF-UHFFFAOYSA-N
XLogP1.22
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[6-(2-aminobutyl)-3-pyridinyl]oxy]-N-cyclopropylpropanamide
CID 79795592
2-[[6-(2-aminobutyl)-3-pyridinyl]oxy]-N-prop-2-ynylpropanamide
CID 79795171
1-(5-pentan-2-yloxy-2-pyridinyl)butan-2-amine
CID 114012794
2-[[6-(2-aminopropyl)-3-pyridinyl]oxy]propanamide
CID 79796082
2-[(6-bromo-3-pyridinyl)oxy]-N,N-dimethylpropanamide
CID 107396753
2-[[6-(2-aminobutyl)-3-pyridinyl]oxy]butanenitrile
CID 79795412
1-(5-propoxy-2-pyridinyl)butan-2-amine
CID 79795245
1-(5-butoxy-2-pyridinyl)butan-2-amine
CID 79796005
N,N-dimethyl-2-(4-propanoylphenoxy)propanamide
CID 43085562
methyl 3-[[6-(2-aminobutyl)-3-pyridinyl]oxy]-2,2-dimethylpropanoate
CID 79796345
2-[[6-(2-aminobutyl)-3-pyridinyl]oxy]-N-(1-methoxypropan-2-yl)acetamide
CID 79790819
1-(5-butan-2-yloxy-2-pyridinyl)propan-2-amine
CID 79799813

Frequently Asked Questions

What is the IUPAC name of 2-[[6-(2-aminobutyl)-3-pyridinyl]oxy]-N,N-dimethylpropanamide?
The IUPAC name of 2-[[6-(2-aminobutyl)-3-pyridinyl]oxy]-N,N-dimethylpropanamide (CID 79795923) is 2-[[6-(2-aminobutyl)-3-pyridinyl]oxy]-N,N-dimethylpropanamide.
What is the SMILES notation for 2-[[6-(2-aminobutyl)-3-pyridinyl]oxy]-N,N-dimethylpropanamide?
The canonical SMILES for 2-[[6-(2-aminobutyl)-3-pyridinyl]oxy]-N,N-dimethylpropanamide is CCC(N)Cc1ccc(OC(C)C(=O)N(C)C)cn1.
What is the InChIKey of 2-[[6-(2-aminobutyl)-3-pyridinyl]oxy]-N,N-dimethylpropanamide?
The InChIKey is WPZZRWSNCGDFLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-5-11(15)8-12-6-7-13(9-16-12)19-10(2)14(18)17(3)4/h6-7,9-11H,5,8,15H2,1-4H3.
What are the key properties of 2-[[6-(2-aminobutyl)-3-pyridinyl]oxy]-N,N-dimethylpropanamide?
2-[[6-(2-aminobutyl)-3-pyridinyl]oxy]-N,N-dimethylpropanamide has a molecular weight of 265.36 g/mol, XLogP of 1.22, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-(2-aminobutyl)-3-pyridinyl]oxy]-N,N-dimethylpropanamide is sourced from PubChem (CID 79795923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).