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

C14H21N3O2 — CID 79150558

IUPAC2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-cyclopentylacetamide
SMILESCc1ccc(OCC(=O)NC2CCCC2)c(CN)n1
InChIInChI=1S/C14H21N3O2/c1-10-6-7-13(12(8-15)16-10)19-9-14(18)17-11-4-2-3-5-11/h6-7,11H,2-5,8-9,15H2,1H3,(H,17,18)
InChIKeyCPLVACSHTFXRKZ-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.29
Rot. Bonds5

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

2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-cyclopentylacetamide (PubChem CID 79150558) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is 2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-cyclopentylacetamide.

Molecular Properties

Compound Name2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-cyclopentylacetamide
PubChem CID79150558
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-cyclopentylacetamide
SMILESCc1ccc(OCC(=O)NC2CCCC2)c(CN)n1
InChIInChI=1S/C14H21N3O2/c1-10-6-7-13(12(8-15)16-10)19-9-14(18)17-11-4-2-3-5-11/h6-7,11H,2-5,8-9,15H2,1H3,(H,17,18)
InChIKeyCPLVACSHTFXRKZ-UHFFFAOYSA-N
XLogP1.29
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-cyclohexylacetamide
CID 79162821
methyl 2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]acetate
CID 79151411
2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-cyclopropylpropanamide
CID 79163623
2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-N-[(3R)-1-pyrimidin-2-ylpiperidin-3-yl]acetamide
CID 95717925
N-cyclopropyl-2-(2-methylquinolin-8-yl)oxyacetamide
CID 40512032
2-[[2-[(cyclopropylamino)methyl]-6-methyl-3-pyridinyl]oxy]-N-propylacetamide
CID 79158938
3-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-methylpropanamide
CID 79162338
2-[2-(2-aminoethyl)-4-methylphenoxy]-N-cyclohexylacetamide
CID 63325796
N-[(3S)-1,1-dioxo-2,3-dihydrothiophen-3-yl]-2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]acetamide
CID 95230755
2-[[2-(hydroxymethyl)-6-methyl-3-pyridinyl]oxy]-N-methylacetamide
CID 79157830
2-[[2-[(cyclopropylamino)methyl]-6-methyl-3-pyridinyl]oxy]-N-prop-2-enylacetamide
CID 79158298
N-carbamoyl-2-[[6-methyl-2-(methylaminomethyl)-3-pyridinyl]oxy]acetamide
CID 79150653

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-cyclopentylacetamide?
The IUPAC name of 2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-cyclopentylacetamide (CID 79150558) is 2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-cyclopentylacetamide.
What is the SMILES notation for 2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-cyclopentylacetamide?
The canonical SMILES for 2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-cyclopentylacetamide is Cc1ccc(OCC(=O)NC2CCCC2)c(CN)n1.
What is the InChIKey of 2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-cyclopentylacetamide?
The InChIKey is CPLVACSHTFXRKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-10-6-7-13(12(8-15)16-10)19-9-14(18)17-11-4-2-3-5-11/h6-7,11H,2-5,8-9,15H2,1H3,(H,17,18).
What are the key properties of 2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-cyclopentylacetamide?
2-[[2-(aminomethyl)-6-methyl-3-pyridinyl]oxy]-N-cyclopentylacetamide has a molecular weight of 263.34 g/mol, XLogP of 1.29, 5 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-cyclopentylacetamide is sourced from PubChem (CID 79150558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).