methyl 2-[imidazo[1,2-a]pyridine-2-carbonyl(methyl)amino]acetate

C12H13N3O3 — CID 43408804

IUPACmethyl 2-[imidazo[1,2-a]pyridine-2-carbonyl(methyl)amino]acetate
SMILESCOC(=O)CN(C)C(=O)c1cn2ccccc2n1
InChIInChI=1S/C12H13N3O3/c1-14(8-11(16)18-2)12(17)9-7-15-6-4-3-5-10(15)13-9/h3-7H,8H2,1-2H3
InChIKeyVKRWFUSFZZZJFA-UHFFFAOYSA-N
MW247.25 g/mol
LogP0.58
Rot. Bonds3

About methyl 2-[imidazo[1,2-a]pyridine-2-carbonyl(methyl)amino]acetate

methyl 2-[imidazo[1,2-a]pyridine-2-carbonyl(methyl)amino]acetate (PubChem CID 43408804) has the molecular formula C12H13N3O3 and a molecular weight of 247.25 g/mol. Its IUPAC name is methyl 2-[imidazo[1,2-a]pyridine-2-carbonyl(methyl)amino]acetate.

Molecular Properties

Compound Namemethyl 2-[imidazo[1,2-a]pyridine-2-carbonyl(methyl)amino]acetate
PubChem CID43408804
Molecular FormulaC12H13N3O3
Molecular Weight247.25 g/mol
Exact Mass247.10
IUPAC Namemethyl 2-[imidazo[1,2-a]pyridine-2-carbonyl(methyl)amino]acetate
SMILESCOC(=O)CN(C)C(=O)c1cn2ccccc2n1
InChIInChI=1S/C12H13N3O3/c1-14(8-11(16)18-2)12(17)9-7-15-6-4-3-5-10(15)13-9/h3-7H,8H2,1-2H3
InChIKeyVKRWFUSFZZZJFA-UHFFFAOYSA-N
XLogP0.58
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.25
LogP ≤ 50.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 2-[imidazo[1,2-a]pyridine-2-carbonyl(propyl)amino]acetate
CID 60778991
N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 51146019
N-(2-methoxyethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 51253266
N-methoxyimidazo[1,2-a]pyridine-2-carboxamide
CID 60716999
1-imidazo[1,2-a]pyridin-2-ylethanone
CID 11194486
methyl 2-[methyl(pyridine-2-carbonyl)amino]acetate
CID 43407333
methyl 3-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)-methylamino]propanoate
CID 61031707
N-[(2-chloro-6-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 4878432
N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 53193511
N-(aminomethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 66612183
N-(2-methoxy-1-pyridin-2-ylethyl)-N-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 74239636
2-[(2-amino-2-oxoethyl)-(imidazo[1,2-a]pyridine-2-carbonyl)amino]acetic acid
CID 107434497

Frequently Asked Questions

What is the IUPAC name of methyl 2-[imidazo[1,2-a]pyridine-2-carbonyl(methyl)amino]acetate?
The IUPAC name of methyl 2-[imidazo[1,2-a]pyridine-2-carbonyl(methyl)amino]acetate (CID 43408804) is methyl 2-[imidazo[1,2-a]pyridine-2-carbonyl(methyl)amino]acetate.
What is the SMILES notation for methyl 2-[imidazo[1,2-a]pyridine-2-carbonyl(methyl)amino]acetate?
The canonical SMILES for methyl 2-[imidazo[1,2-a]pyridine-2-carbonyl(methyl)amino]acetate is COC(=O)CN(C)C(=O)c1cn2ccccc2n1.
What is the InChIKey of methyl 2-[imidazo[1,2-a]pyridine-2-carbonyl(methyl)amino]acetate?
The InChIKey is VKRWFUSFZZZJFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O3/c1-14(8-11(16)18-2)12(17)9-7-15-6-4-3-5-10(15)13-9/h3-7H,8H2,1-2H3.
What are the key properties of methyl 2-[imidazo[1,2-a]pyridine-2-carbonyl(methyl)amino]acetate?
methyl 2-[imidazo[1,2-a]pyridine-2-carbonyl(methyl)amino]acetate has a molecular weight of 247.25 g/mol, XLogP of 0.58, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[imidazo[1,2-a]pyridine-2-carbonyl(methyl)amino]acetate is sourced from PubChem (CID 43408804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).