2-[2-(imidazo[1,2-a]pyridin-2-ylmethylamino)ethoxy]acetamide

C12H16N4O2 — CID 106236565

IUPAC2-[2-(imidazo[1,2-a]pyridin-2-ylmethylamino)ethoxy]acetamide
SMILESNC(=O)COCCNCc1cn2ccccc2n1
InChIInChI=1S/C12H16N4O2/c13-11(17)9-18-6-4-14-7-10-8-16-5-2-1-3-12(16)15-10/h1-3,5,8,14H,4,6-7,9H2,(H2,13,17)
InChIKeyLSCAGSLDTVLHJO-UHFFFAOYSA-N
MW248.29 g/mol
LogP-0.07
Rot. Bonds7

About 2-[2-(imidazo[1,2-a]pyridin-2-ylmethylamino)ethoxy]acetamide

2-[2-(imidazo[1,2-a]pyridin-2-ylmethylamino)ethoxy]acetamide (PubChem CID 106236565) has the molecular formula C12H16N4O2 and a molecular weight of 248.29 g/mol. Its IUPAC name is 2-[2-(imidazo[1,2-a]pyridin-2-ylmethylamino)ethoxy]acetamide.

Molecular Properties

Compound Name2-[2-(imidazo[1,2-a]pyridin-2-ylmethylamino)ethoxy]acetamide
PubChem CID106236565
Molecular FormulaC12H16N4O2
Molecular Weight248.29 g/mol
Exact Mass248.13
IUPAC Name2-[2-(imidazo[1,2-a]pyridin-2-ylmethylamino)ethoxy]acetamide
SMILESNC(=O)COCCNCc1cn2ccccc2n1
InChIInChI=1S/C12H16N4O2/c13-11(17)9-18-6-4-14-7-10-8-16-5-2-1-3-12(16)15-10/h1-3,5,8,14H,4,6-7,9H2,(H2,13,17)
InChIKeyLSCAGSLDTVLHJO-UHFFFAOYSA-N
XLogP-0.07
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.29
LogP ≤ 5-0.07
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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Frequently Asked Questions

What is the IUPAC name of 2-[2-(imidazo[1,2-a]pyridin-2-ylmethylamino)ethoxy]acetamide?
The IUPAC name of 2-[2-(imidazo[1,2-a]pyridin-2-ylmethylamino)ethoxy]acetamide (CID 106236565) is 2-[2-(imidazo[1,2-a]pyridin-2-ylmethylamino)ethoxy]acetamide.
What is the SMILES notation for 2-[2-(imidazo[1,2-a]pyridin-2-ylmethylamino)ethoxy]acetamide?
The canonical SMILES for 2-[2-(imidazo[1,2-a]pyridin-2-ylmethylamino)ethoxy]acetamide is NC(=O)COCCNCc1cn2ccccc2n1.
What is the InChIKey of 2-[2-(imidazo[1,2-a]pyridin-2-ylmethylamino)ethoxy]acetamide?
The InChIKey is LSCAGSLDTVLHJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O2/c13-11(17)9-18-6-4-14-7-10-8-16-5-2-1-3-12(16)15-10/h1-3,5,8,14H,4,6-7,9H2,(H2,13,17).
What are the key properties of 2-[2-(imidazo[1,2-a]pyridin-2-ylmethylamino)ethoxy]acetamide?
2-[2-(imidazo[1,2-a]pyridin-2-ylmethylamino)ethoxy]acetamide has a molecular weight of 248.29 g/mol, XLogP of -0.07, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(imidazo[1,2-a]pyridin-2-ylmethylamino)ethoxy]acetamide is sourced from PubChem (CID 106236565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).