5-methyl-2-(5-methyl-1,2-oxazol-4-yl)-1H-imidazo[1,2-a]imidazole-6-carboxylic acid

C11H10N4O3 — CID 82384675

IUPAC5-methyl-2-(5-methyl-1,2-oxazol-4-yl)-1H-imidazo[1,2-a]imidazole-6-carboxylic acid
SMILESCc1oncc1-c1cn2c(C)c(C(=O)O)nc2[nH]1
InChIInChI=1S/C11H10N4O3/c1-5-9(10(16)17)14-11-13-8(4-15(5)11)7-3-12-18-6(7)2/h3-4H,1-2H3,(H,13,14)(H,16,17)
InChIKeySNTRQBKVVSDXFA-UHFFFAOYSA-N
MW246.23 g/mol
LogP1.63
Rot. Bonds2

About 5-methyl-2-(5-methyl-1,2-oxazol-4-yl)-1H-imidazo[1,2-a]imidazole-6-carboxylic acid

5-methyl-2-(5-methyl-1,2-oxazol-4-yl)-1H-imidazo[1,2-a]imidazole-6-carboxylic acid (PubChem CID 82384675) has the molecular formula C11H10N4O3 and a molecular weight of 246.23 g/mol. Its IUPAC name is 5-methyl-2-(5-methyl-1,2-oxazol-4-yl)-1H-imidazo[1,2-a]imidazole-6-carboxylic acid.

Molecular Properties

Compound Name5-methyl-2-(5-methyl-1,2-oxazol-4-yl)-1H-imidazo[1,2-a]imidazole-6-carboxylic acid
PubChem CID82384675
Molecular FormulaC11H10N4O3
Molecular Weight246.23 g/mol
Exact Mass246.08
IUPAC Name5-methyl-2-(5-methyl-1,2-oxazol-4-yl)-1H-imidazo[1,2-a]imidazole-6-carboxylic acid
SMILESCc1oncc1-c1cn2c(C)c(C(=O)O)nc2[nH]1
InChIInChI=1S/C11H10N4O3/c1-5-9(10(16)17)14-11-13-8(4-15(5)11)7-3-12-18-6(7)2/h3-4H,1-2H3,(H,13,14)(H,16,17)
InChIKeySNTRQBKVVSDXFA-UHFFFAOYSA-N
XLogP1.63
TPSA96.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.23
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-methyl-2-(5-methyl-1,2-oxazol-4-yl)-1H-imidazo[1,2-a]imidazole-6-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(2-methyl-1H-imidazo[1,2-a]imidazol-6-yl)-1,2-oxazole-5-carboxylic acid
CID 82373614
3-(7H-imidazo[1,2-a]imidazol-6-yl)-4-methyl-1,2-oxazole-5-carboxylic acid
CID 82373622
4-methyl-3-(2-methyl-1H-imidazo[1,2-a]imidazol-6-yl)-1,2-oxazole-5-carboxylic acid
CID 82373623
4-(7H-imidazo[1,2-a]imidazol-6-yl)-3-methyl-1,2-oxazole-5-carboxylic acid
CID 82373645
3-methyl-4-(2-methyl-1H-imidazo[1,2-a]imidazol-6-yl)-1,2-oxazole-5-carboxylic acid
CID 82373646
5-methyl-2-(3-methyl-1,2-oxazol-5-yl)-1H-imidazo[1,2-a]imidazole-6-carboxylic acid
CID 82384674
2-[6-(4-methyl-1,2-oxazol-5-yl)-7H-imidazo[1,2-a]imidazol-3-yl]acetic acid
CID 82384676
2-[6-(3-methyl-1,2-oxazol-5-yl)-7H-imidazo[1,2-a]imidazol-3-yl]acetic acid
CID 82384678
4-(2-methyl-1H-imidazo[1,2-a]imidazol-6-yl)-1,2,5-oxadiazole-3-carboxylic acid
CID 82390172
2-(5-methyl-1,2-oxazol-4-yl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole-6-carboxylic acid
CID 112483517
2-(3-methyl-1,2-oxazol-5-yl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid
CID 136923438

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(5-methyl-1,2-oxazol-4-yl)-1H-imidazo[1,2-a]imidazole-6-carboxylic acid?
The IUPAC name of 5-methyl-2-(5-methyl-1,2-oxazol-4-yl)-1H-imidazo[1,2-a]imidazole-6-carboxylic acid (CID 82384675) is 5-methyl-2-(5-methyl-1,2-oxazol-4-yl)-1H-imidazo[1,2-a]imidazole-6-carboxylic acid.
What is the SMILES notation for 5-methyl-2-(5-methyl-1,2-oxazol-4-yl)-1H-imidazo[1,2-a]imidazole-6-carboxylic acid?
The canonical SMILES for 5-methyl-2-(5-methyl-1,2-oxazol-4-yl)-1H-imidazo[1,2-a]imidazole-6-carboxylic acid is Cc1oncc1-c1cn2c(C)c(C(=O)O)nc2[nH]1.
What is the InChIKey of 5-methyl-2-(5-methyl-1,2-oxazol-4-yl)-1H-imidazo[1,2-a]imidazole-6-carboxylic acid?
The InChIKey is SNTRQBKVVSDXFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4O3/c1-5-9(10(16)17)14-11-13-8(4-15(5)11)7-3-12-18-6(7)2/h3-4H,1-2H3,(H,13,14)(H,16,17).
What are the key properties of 5-methyl-2-(5-methyl-1,2-oxazol-4-yl)-1H-imidazo[1,2-a]imidazole-6-carboxylic acid?
5-methyl-2-(5-methyl-1,2-oxazol-4-yl)-1H-imidazo[1,2-a]imidazole-6-carboxylic acid has a molecular weight of 246.23 g/mol, XLogP of 1.63, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(5-methyl-1,2-oxazol-4-yl)-1H-imidazo[1,2-a]imidazole-6-carboxylic acid is sourced from PubChem (CID 82384675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).