2-[3-(2-aminoethyl)-2-methylimidazo[1,2-a]pyridin-8-yl]oxy-N-butylacetamide

C16H24N4O2 — CID 82055769

IUPAC2-[3-(2-aminoethyl)-2-methylimidazo[1,2-a]pyridin-8-yl]oxy-N-butylacetamide
SMILESCCCCNC(=O)COc1cccn2c(CCN)c(C)nc12
InChIInChI=1S/C16H24N4O2/c1-3-4-9-18-15(21)11-22-14-6-5-10-20-13(7-8-17)12(2)19-16(14)20/h5-6,10H,3-4,7-9,11,17H2,1-2H3,(H,18,21)
InChIKeyIHFSNWYQXCSCPZ-UHFFFAOYSA-N
MW304.39 g/mol
LogP1.44
Rot. Bonds8

About 2-[3-(2-aminoethyl)-2-methylimidazo[1,2-a]pyridin-8-yl]oxy-N-butylacetamide

2-[3-(2-aminoethyl)-2-methylimidazo[1,2-a]pyridin-8-yl]oxy-N-butylacetamide (PubChem CID 82055769) has the molecular formula C16H24N4O2 and a molecular weight of 304.39 g/mol. Its IUPAC name is 2-[3-(2-aminoethyl)-2-methylimidazo[1,2-a]pyridin-8-yl]oxy-N-butylacetamide.

Molecular Properties

Compound Name2-[3-(2-aminoethyl)-2-methylimidazo[1,2-a]pyridin-8-yl]oxy-N-butylacetamide
PubChem CID82055769
Molecular FormulaC16H24N4O2
Molecular Weight304.39 g/mol
Exact Mass304.19
IUPAC Name2-[3-(2-aminoethyl)-2-methylimidazo[1,2-a]pyridin-8-yl]oxy-N-butylacetamide
SMILESCCCCNC(=O)COc1cccn2c(CCN)c(C)nc12
InChIInChI=1S/C16H24N4O2/c1-3-4-9-18-15(21)11-22-14-6-5-10-20-13(7-8-17)12(2)19-16(14)20/h5-6,10H,3-4,7-9,11,17H2,1-2H3,(H,18,21)
InChIKeyIHFSNWYQXCSCPZ-UHFFFAOYSA-N
XLogP1.44
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(8-heptoxy-2-methylimidazo[1,2-a]pyridin-3-yl)ethanamine
CID 82055785
2-(8-ethoxy-2-methylimidazo[1,2-a]pyridin-3-yl)ethanamine
CID 82055784
2-[3-(aminomethyl)imidazo[1,2-a]pyridin-8-yl]oxy-N-butylacetamide
CID 82056308
2-[[1-(3-aminopropyl)-2-oxo-3-pyridinyl]oxy]-N-butylacetamide
CID 82056257
2-[8-(2-amino-2-oxoethoxy)-2-methylimidazo[1,2-a]pyridin-3-yl]acetic acid
CID 82055736
2-(2-amino-3-methylphenoxy)-N-butylacetamide
CID 54956172
2-[[1-(1-aminopropan-2-yl)-2-oxo-3-pyridinyl]oxy]-N-butylacetamide
CID 82143796
2-(5-amino-2-methylphenoxy)-N-butylacetamide
CID 54956173
2-(2-bromophenoxy)-N-butylacetamide
CID 55029150
2-(2-methylphenoxy)-N-pentylacetamide
CID 110756249
2-[2-methyl-8-(2-methylprop-2-enoxy)imidazo[1,2-a]pyridin-3-yl]acetic acid
CID 82055750
2-[[1-(3-aminopropyl)-2-oxo-3-pyridinyl]oxy]-N-propylacetamide
CID 82056289

Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-aminoethyl)-2-methylimidazo[1,2-a]pyridin-8-yl]oxy-N-butylacetamide?
The IUPAC name of 2-[3-(2-aminoethyl)-2-methylimidazo[1,2-a]pyridin-8-yl]oxy-N-butylacetamide (CID 82055769) is 2-[3-(2-aminoethyl)-2-methylimidazo[1,2-a]pyridin-8-yl]oxy-N-butylacetamide.
What is the SMILES notation for 2-[3-(2-aminoethyl)-2-methylimidazo[1,2-a]pyridin-8-yl]oxy-N-butylacetamide?
The canonical SMILES for 2-[3-(2-aminoethyl)-2-methylimidazo[1,2-a]pyridin-8-yl]oxy-N-butylacetamide is CCCCNC(=O)COc1cccn2c(CCN)c(C)nc12.
What is the InChIKey of 2-[3-(2-aminoethyl)-2-methylimidazo[1,2-a]pyridin-8-yl]oxy-N-butylacetamide?
The InChIKey is IHFSNWYQXCSCPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O2/c1-3-4-9-18-15(21)11-22-14-6-5-10-20-13(7-8-17)12(2)19-16(14)20/h5-6,10H,3-4,7-9,11,17H2,1-2H3,(H,18,21).
What are the key properties of 2-[3-(2-aminoethyl)-2-methylimidazo[1,2-a]pyridin-8-yl]oxy-N-butylacetamide?
2-[3-(2-aminoethyl)-2-methylimidazo[1,2-a]pyridin-8-yl]oxy-N-butylacetamide has a molecular weight of 304.39 g/mol, XLogP of 1.44, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-aminoethyl)-2-methylimidazo[1,2-a]pyridin-8-yl]oxy-N-butylacetamide is sourced from PubChem (CID 82055769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).