2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-pentan-2-ylpropanamide

C15H25N3O2 — CID 79163530

IUPAC2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-pentan-2-ylpropanamide
SMILESCCCC(C)NC(=O)C(C)Oc1ccc(C)nc1CN
InChIInChI=1S/C15H25N3O2/c1-5-6-10(2)18-15(19)12(4)20-14-8-7-11(3)17-13(14)9-16/h7-8,10,12H,5-6,9,16H2,1-4H3,(H,18,19)
InChIKeyPOZAYBZIYXSVKU-UHFFFAOYSA-N
MW279.38 g/mol
LogP1.92
Rot. Bonds7

About 2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-pentan-2-ylpropanamide

2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-pentan-2-ylpropanamide (PubChem CID 79163530) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is 2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-pentan-2-ylpropanamide.

Molecular Properties

Compound Name2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-pentan-2-ylpropanamide
PubChem CID79163530
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC Name2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-pentan-2-ylpropanamide
SMILESCCCC(C)NC(=O)C(C)Oc1ccc(C)nc1CN
InChIInChI=1S/C15H25N3O2/c1-5-6-10(2)18-15(19)12(4)20-14-8-7-11(3)17-13(14)9-16/h7-8,10,12H,5-6,9,16H2,1-4H3,(H,18,19)
InChIKeyPOZAYBZIYXSVKU-UHFFFAOYSA-N
XLogP1.92
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-cyclopropylpropanamide
CID 79163623
N-butyl-2-[[2-(ethylaminomethyl)-6-methyl-3-pyridinyl]oxy]propanamide
CID 79157524
2-[[6-methyl-2-(methylaminomethyl)-3-pyridinyl]oxy]-N-propylpropanamide
CID 79150870
2-[[2-(2-aminoethyl)-6-methyl-3-pyridinyl]oxy]-N-ethylpropanamide
CID 79169410
2-[[2-(hydroxymethyl)-6-methyl-3-pyridinyl]oxy]-N-propylpropanamide
CID 79157055
N-ethyl-2-[[2-(ethylaminomethyl)-6-methyl-3-pyridinyl]oxy]propanamide
CID 79151205
N-ethyl-2-[[6-methyl-2-(propylaminomethyl)-3-pyridinyl]oxy]propanamide
CID 79150446
methyl 2-[[6-methyl-2-(propylaminomethyl)-3-pyridinyl]oxy]propanoate
CID 79151146
N-ethyl-2-[[6-methyl-2-(methylaminomethyl)-3-pyridinyl]oxy]propanamide
CID 79151419
ethyl 2-[[2-(hydroxymethyl)-6-methyl-3-pyridinyl]oxy]propanoate
CID 79169271
2-[2-(2-aminoethyl)-4-methylphenoxy]-N-pentan-2-ylpropanamide
CID 63326228
(6-methyl-3-propan-2-yloxy-2-pyridinyl)methanamine
CID 79163718

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-pentan-2-ylpropanamide?
The IUPAC name of 2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-pentan-2-ylpropanamide (CID 79163530) is 2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-pentan-2-ylpropanamide.
What is the SMILES notation for 2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-pentan-2-ylpropanamide?
The canonical SMILES for 2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-pentan-2-ylpropanamide is CCCC(C)NC(=O)C(C)Oc1ccc(C)nc1CN.
What is the InChIKey of 2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-pentan-2-ylpropanamide?
The InChIKey is POZAYBZIYXSVKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-5-6-10(2)18-15(19)12(4)20-14-8-7-11(3)17-13(14)9-16/h7-8,10,12H,5-6,9,16H2,1-4H3,(H,18,19).
What are the key properties of 2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-pentan-2-ylpropanamide?
2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-pentan-2-ylpropanamide has a molecular weight of 279.38 g/mol, XLogP of 1.92, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-pentan-2-ylpropanamide is sourced from PubChem (CID 79163530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).