3-(imidazo[1,2-a]pyridine-2-carbonylamino)-2-methoxypropanoic acid

C12H13N3O4 — CID 106107683

IUPAC3-(imidazo[1,2-a]pyridine-2-carbonylamino)-2-methoxypropanoic acid
SMILESCOC(CNC(=O)c1cn2ccccc2n1)C(=O)O
InChIInChI=1S/C12H13N3O4/c1-19-9(12(17)18)6-13-11(16)8-7-15-5-3-2-4-10(15)14-8/h2-5,7,9H,6H2,1H3,(H,13,16)(H,17,18)
InChIKeyISGIFBQZOYJVFF-UHFFFAOYSA-N
MW263.25 g/mol
LogP0.16
Rot. Bonds5

About 3-(imidazo[1,2-a]pyridine-2-carbonylamino)-2-methoxypropanoic acid

3-(imidazo[1,2-a]pyridine-2-carbonylamino)-2-methoxypropanoic acid (PubChem CID 106107683) has the molecular formula C12H13N3O4 and a molecular weight of 263.25 g/mol. Its IUPAC name is 3-(imidazo[1,2-a]pyridine-2-carbonylamino)-2-methoxypropanoic acid.

Molecular Properties

Compound Name3-(imidazo[1,2-a]pyridine-2-carbonylamino)-2-methoxypropanoic acid
PubChem CID106107683
Molecular FormulaC12H13N3O4
Molecular Weight263.25 g/mol
Exact Mass263.09
IUPAC Name3-(imidazo[1,2-a]pyridine-2-carbonylamino)-2-methoxypropanoic acid
SMILESCOC(CNC(=O)c1cn2ccccc2n1)C(=O)O
InChIInChI=1S/C12H13N3O4/c1-19-9(12(17)18)6-13-11(16)8-7-15-5-3-2-4-10(15)14-8/h2-5,7,9H,6H2,1H3,(H,13,16)(H,17,18)
InChIKeyISGIFBQZOYJVFF-UHFFFAOYSA-N
XLogP0.16
TPSA92.93 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.25
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methoxyethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 51253266
N-methoxyimidazo[1,2-a]pyridine-2-carboxamide
CID 60716999
N-(aminomethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 66612183
2-(imidazo[1,2-a]pyridine-2-carbonylamino)propanoic acid
CID 43170854
(2S)-2-(imidazo[1,2-a]pyridine-2-carbonylamino)-3-methylpentanoic acid
CID 61173973
2-(imidazo[1,2-a]pyridine-2-carbonylamino)pentanoic acid
CID 43630934
1-imidazo[1,2-a]pyridin-2-ylethanone
CID 11194486
N-(4-hydroxy-2,2-dimethylbutyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 103824953
N-[(2,4,6-trimethylphenyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 87051271
N-[(2,5-dimethoxyphenyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 87051264
N-(1-hydroxybutan-2-yl)imidazo[1,2-a]pyridine-2-carboxamide
CID 43419304
N-[(3-hydroxycyclobutyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 66005188

Frequently Asked Questions

What is the IUPAC name of 3-(imidazo[1,2-a]pyridine-2-carbonylamino)-2-methoxypropanoic acid?
The IUPAC name of 3-(imidazo[1,2-a]pyridine-2-carbonylamino)-2-methoxypropanoic acid (CID 106107683) is 3-(imidazo[1,2-a]pyridine-2-carbonylamino)-2-methoxypropanoic acid.
What is the SMILES notation for 3-(imidazo[1,2-a]pyridine-2-carbonylamino)-2-methoxypropanoic acid?
The canonical SMILES for 3-(imidazo[1,2-a]pyridine-2-carbonylamino)-2-methoxypropanoic acid is COC(CNC(=O)c1cn2ccccc2n1)C(=O)O.
What is the InChIKey of 3-(imidazo[1,2-a]pyridine-2-carbonylamino)-2-methoxypropanoic acid?
The InChIKey is ISGIFBQZOYJVFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O4/c1-19-9(12(17)18)6-13-11(16)8-7-15-5-3-2-4-10(15)14-8/h2-5,7,9H,6H2,1H3,(H,13,16)(H,17,18).
What are the key properties of 3-(imidazo[1,2-a]pyridine-2-carbonylamino)-2-methoxypropanoic acid?
3-(imidazo[1,2-a]pyridine-2-carbonylamino)-2-methoxypropanoic acid has a molecular weight of 263.25 g/mol, XLogP of 0.16, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(imidazo[1,2-a]pyridine-2-carbonylamino)-2-methoxypropanoic acid is sourced from PubChem (CID 106107683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).