methyl 3-hydroxy-2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]propanoate

C13H15N3O4 — CID 43408753

IUPACmethyl 3-hydroxy-2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]propanoate
SMILESCOC(=O)C(CO)NC(=O)c1cn2c(C)cccc2n1
InChIInChI=1S/C13H15N3O4/c1-8-4-3-5-11-14-9(6-16(8)11)12(18)15-10(7-17)13(19)20-2/h3-6,10,17H,7H2,1-2H3,(H,15,18)
InChIKeyREQVORHQQCRFHG-UHFFFAOYSA-N
MW277.28 g/mol
LogP-0.09
Rot. Bonds4

About methyl 3-hydroxy-2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]propanoate

methyl 3-hydroxy-2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]propanoate (PubChem CID 43408753) has the molecular formula C13H15N3O4 and a molecular weight of 277.28 g/mol. Its IUPAC name is methyl 3-hydroxy-2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]propanoate.

Molecular Properties

Compound Namemethyl 3-hydroxy-2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]propanoate
PubChem CID43408753
Molecular FormulaC13H15N3O4
Molecular Weight277.28 g/mol
Exact Mass277.11
IUPAC Namemethyl 3-hydroxy-2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]propanoate
SMILESCOC(=O)C(CO)NC(=O)c1cn2c(C)cccc2n1
InChIInChI=1S/C13H15N3O4/c1-8-4-3-5-11-14-9(6-16(8)11)12(18)15-10(7-17)13(19)20-2/h3-6,10,17H,7H2,1-2H3,(H,15,18)
InChIKeyREQVORHQQCRFHG-UHFFFAOYSA-N
XLogP-0.09
TPSA92.93 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.28
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(1,3-dihydroxypropan-2-yl)-5-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 65314901
3-methoxy-2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]propanoic acid
CID 81077384
N-(1-hydroxybutan-2-yl)-5-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 43417880
5-methylimidazo[1,2-a]pyridine-2-carbohydrazide
CID 43236612
3-hydroxy-2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]butanoic acid
CID 43353577
(3R)-3-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]-3-thiophen-2-ylpropanoic acid
CID 95572538
N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 18200859
N-[(1-hydroxycyclobutyl)methyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 115643362
N-[3-(hydroxymethyl)phenyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 60630109
N-(1-hydroxy-3-methylpentan-3-yl)-5-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 103945561
N-(5-hydroxy-2,2-dimethylpentyl)-5-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 103900041
2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid
CID 43357240

Frequently Asked Questions

What is the IUPAC name of methyl 3-hydroxy-2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]propanoate?
The IUPAC name of methyl 3-hydroxy-2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]propanoate (CID 43408753) is methyl 3-hydroxy-2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]propanoate.
What is the SMILES notation for methyl 3-hydroxy-2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]propanoate?
The canonical SMILES for methyl 3-hydroxy-2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]propanoate is COC(=O)C(CO)NC(=O)c1cn2c(C)cccc2n1.
What is the InChIKey of methyl 3-hydroxy-2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]propanoate?
The InChIKey is REQVORHQQCRFHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O4/c1-8-4-3-5-11-14-9(6-16(8)11)12(18)15-10(7-17)13(19)20-2/h3-6,10,17H,7H2,1-2H3,(H,15,18).
What are the key properties of methyl 3-hydroxy-2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]propanoate?
methyl 3-hydroxy-2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]propanoate has a molecular weight of 277.28 g/mol, XLogP of -0.09, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 3-hydroxy-2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]propanoate is sourced from PubChem (CID 43408753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).