2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]butanoic acid

C13H15N3O3 — CID 43469348

IUPAC2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]butanoic acid
SMILESCCC(NC(=O)Cc1cn2ccccc2n1)C(=O)O
InChIInChI=1S/C13H15N3O3/c1-2-10(13(18)19)15-12(17)7-9-8-16-6-4-3-5-11(16)14-9/h3-6,8,10H,2,7H2,1H3,(H,15,17)(H,18,19)
InChIKeyWRAZJDJVHFSCNV-UHFFFAOYSA-N
MW261.28 g/mol
LogP0.86
Rot. Bonds5

About 2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]butanoic acid

2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]butanoic acid (PubChem CID 43469348) has the molecular formula C13H15N3O3 and a molecular weight of 261.28 g/mol. Its IUPAC name is 2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]butanoic acid.

Molecular Properties

Compound Name2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]butanoic acid
PubChem CID43469348
Molecular FormulaC13H15N3O3
Molecular Weight261.28 g/mol
Exact Mass261.11
IUPAC Name2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]butanoic acid
SMILESCCC(NC(=O)Cc1cn2ccccc2n1)C(=O)O
InChIInChI=1S/C13H15N3O3/c1-2-10(13(18)19)15-12(17)7-9-8-16-6-4-3-5-11(16)14-9/h3-6,8,10H,2,7H2,1H3,(H,15,17)(H,18,19)
InChIKeyWRAZJDJVHFSCNV-UHFFFAOYSA-N
XLogP0.86
TPSA83.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]pentanoic acid
CID 43630447
(E)-2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]hex-4-enoic acid
CID 120693374
2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]propanoic acid
CID 43355303
2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]-3-methylbutanoic acid
CID 43353990
N-(1-hydroxybutan-2-yl)-2-imidazo[1,2-a]pyridin-2-ylacetamide
CID 43417878
3-hydroxy-2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]butanoic acid
CID 43353673
(2S)-2-hydroxy-3-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]propanoic acid
CID 107833206
2-[[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]methyl]-3-methylbutanoic acid
CID 65220306
N-(1-aminohexan-2-yl)-2-imidazo[1,2-a]pyridin-2-ylacetamide
CID 119664981
2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]acetic acid
CID 43170541
N-(1-hydroxy-4,4-dimethylpentan-3-yl)-2-imidazo[1,2-a]pyridin-2-ylacetamide
CID 103941094
N-(1-aminohexan-2-yl)-2-imidazo[1,2-a]pyridin-2-ylacetamide;dihydrochloride
CID 119664980

Frequently Asked Questions

What is the IUPAC name of 2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]butanoic acid?
The IUPAC name of 2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]butanoic acid (CID 43469348) is 2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]butanoic acid.
What is the SMILES notation for 2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]butanoic acid?
The canonical SMILES for 2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]butanoic acid is CCC(NC(=O)Cc1cn2ccccc2n1)C(=O)O.
What is the InChIKey of 2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]butanoic acid?
The InChIKey is WRAZJDJVHFSCNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O3/c1-2-10(13(18)19)15-12(17)7-9-8-16-6-4-3-5-11(16)14-9/h3-6,8,10H,2,7H2,1H3,(H,15,17)(H,18,19).
What are the key properties of 2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]butanoic acid?
2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]butanoic acid has a molecular weight of 261.28 g/mol, XLogP of 0.86, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]butanoic acid is sourced from PubChem (CID 43469348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).