2-(5-chloro-2-methyl-3H-imidazo[1,2-a]benzimidazol-1-yl)acetic acid

C12H10ClN3O2 — CID 84639275

IUPAC2-(5-chloro-2-methyl-3H-imidazo[1,2-a]benzimidazol-1-yl)acetic acid
SMILESCc1[nH]c2nc3c(Cl)cccc3n2c1CC(=O)O
InChIInChI=1S/C12H10ClN3O2/c1-6-9(5-10(17)18)16-8-4-2-3-7(13)11(8)15-12(16)14-6/h2-4H,5H2,1H3,(H,14,15)(H,17,18)
InChIKeyQNSGUKCZCDVJLD-UHFFFAOYSA-N
MW263.68 g/mol
LogP2.40
Rot. Bonds2

About 2-(5-chloro-2-methyl-3H-imidazo[1,2-a]benzimidazol-1-yl)acetic acid

2-(5-chloro-2-methyl-3H-imidazo[1,2-a]benzimidazol-1-yl)acetic acid (PubChem CID 84639275) has the molecular formula C12H10ClN3O2 and a molecular weight of 263.68 g/mol. Its IUPAC name is 2-(5-chloro-2-methyl-3H-imidazo[1,2-a]benzimidazol-1-yl)acetic acid.

Molecular Properties

Compound Name2-(5-chloro-2-methyl-3H-imidazo[1,2-a]benzimidazol-1-yl)acetic acid
PubChem CID84639275
Molecular FormulaC12H10ClN3O2
Molecular Weight263.68 g/mol
Exact Mass263.05
IUPAC Name2-(5-chloro-2-methyl-3H-imidazo[1,2-a]benzimidazol-1-yl)acetic acid
SMILESCc1[nH]c2nc3c(Cl)cccc3n2c1CC(=O)O
InChIInChI=1S/C12H10ClN3O2/c1-6-9(5-10(17)18)16-8-4-2-3-7(13)11(8)15-12(16)14-6/h2-4H,5H2,1H3,(H,14,15)(H,17,18)
InChIKeyQNSGUKCZCDVJLD-UHFFFAOYSA-N
XLogP2.40
TPSA70.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.68
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(5-chloro-2-methyl-3H-imidazo[1,2-a]benzimidazol-1-yl)acetic 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-(1-bromo-5-chloro-3H-imidazo[1,2-a]benzimidazol-2-yl)propanoic acid
CID 84646743
2-(1-bromo-5-propan-2-yl-3H-imidazo[1,2-a]benzimidazol-2-yl)acetic acid
CID 84646575
5-chloro-1-ethenyl-2-[(Z)-prop-1-enyl]-3H-imidazo[1,2-a]benzimidazole
CID 145283610
2-(8-chloro-2-methylquinolin-3-yl)acetic acid
CID 164563362
3-(1-bromo-5-ethyl-3H-imidazo[1,2-a]benzimidazol-2-yl)propanoic acid
CID 84646573
2-(5-ethyl-2,3-dimethylimidazo[1,2-a]benzimidazol-1-yl)acetic acid
CID 84641639
2-(1-chloro-3-methylimidazo[1,5-a]pyridin-5-yl)acetic acid
CID 83839544
2-[4-chloro-1-(3-methylbutan-2-yl)benzimidazol-2-yl]sulfanylacetic acid
CID 104836688
2-(4-chloro-1,3-benzothiazol-2-yl)acetic acid
CID 71743774
3-(2-amino-4-chlorobenzimidazol-1-yl)propanoic acid
CID 84736899
2-[4-chloro-1-(4-methylpentan-2-yl)benzimidazol-2-yl]sulfanylacetic acid
CID 104836697
2-[6-(furan-2-yl)-2-methyl-1H-imidazo[1,2-a]imidazol-3-yl]acetic acid
CID 82385288

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2-methyl-3H-imidazo[1,2-a]benzimidazol-1-yl)acetic acid?
The IUPAC name of 2-(5-chloro-2-methyl-3H-imidazo[1,2-a]benzimidazol-1-yl)acetic acid (CID 84639275) is 2-(5-chloro-2-methyl-3H-imidazo[1,2-a]benzimidazol-1-yl)acetic acid.
What is the SMILES notation for 2-(5-chloro-2-methyl-3H-imidazo[1,2-a]benzimidazol-1-yl)acetic acid?
The canonical SMILES for 2-(5-chloro-2-methyl-3H-imidazo[1,2-a]benzimidazol-1-yl)acetic acid is Cc1[nH]c2nc3c(Cl)cccc3n2c1CC(=O)O.
What is the InChIKey of 2-(5-chloro-2-methyl-3H-imidazo[1,2-a]benzimidazol-1-yl)acetic acid?
The InChIKey is QNSGUKCZCDVJLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClN3O2/c1-6-9(5-10(17)18)16-8-4-2-3-7(13)11(8)15-12(16)14-6/h2-4H,5H2,1H3,(H,14,15)(H,17,18).
What are the key properties of 2-(5-chloro-2-methyl-3H-imidazo[1,2-a]benzimidazol-1-yl)acetic acid?
2-(5-chloro-2-methyl-3H-imidazo[1,2-a]benzimidazol-1-yl)acetic acid has a molecular weight of 263.68 g/mol, XLogP of 2.40, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2-methyl-3H-imidazo[1,2-a]benzimidazol-1-yl)acetic acid is sourced from PubChem (CID 84639275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).