2-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]pentanoic acid

C15H19N3O4 — CID 110496809

IUPAC2-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]pentanoic acid
SMILESCCCC(NC(=O)COc1cccn2cc(C)nc12)C(=O)O
InChIInChI=1S/C15H19N3O4/c1-3-5-11(15(20)21)17-13(19)9-22-12-6-4-7-18-8-10(2)16-14(12)18/h4,6-8,11H,3,5,9H2,1-2H3,(H,17,19)(H,20,21)
InChIKeyIPOXLPMCLRGYEC-UHFFFAOYSA-N
MW305.33 g/mol
LogP1.39
Rot. Bonds7

About 2-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]pentanoic acid

2-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]pentanoic acid (PubChem CID 110496809) has the molecular formula C15H19N3O4 and a molecular weight of 305.33 g/mol. Its IUPAC name is 2-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]pentanoic acid.

Molecular Properties

Compound Name2-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]pentanoic acid
PubChem CID110496809
Molecular FormulaC15H19N3O4
Molecular Weight305.33 g/mol
Exact Mass305.14
IUPAC Name2-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]pentanoic acid
SMILESCCCC(NC(=O)COc1cccn2cc(C)nc12)C(=O)O
InChIInChI=1S/C15H19N3O4/c1-3-5-11(15(20)21)17-13(19)9-22-12-6-4-7-18-8-10(2)16-14(12)18/h4,6-8,11H,3,5,9H2,1-2H3,(H,17,19)(H,20,21)
InChIKeyIPOXLPMCLRGYEC-UHFFFAOYSA-N
XLogP1.39
TPSA92.93 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.33
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]pentanoic acid?
The IUPAC name of 2-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]pentanoic acid (CID 110496809) is 2-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]pentanoic acid.
What is the SMILES notation for 2-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]pentanoic acid?
The canonical SMILES for 2-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]pentanoic acid is CCCC(NC(=O)COc1cccn2cc(C)nc12)C(=O)O.
What is the InChIKey of 2-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]pentanoic acid?
The InChIKey is IPOXLPMCLRGYEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O4/c1-3-5-11(15(20)21)17-13(19)9-22-12-6-4-7-18-8-10(2)16-14(12)18/h4,6-8,11H,3,5,9H2,1-2H3,(H,17,19)(H,20,21).
What are the key properties of 2-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]pentanoic acid?
2-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]pentanoic acid has a molecular weight of 305.33 g/mol, XLogP of 1.39, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]pentanoic acid is sourced from PubChem (CID 110496809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).