5-(1-methylimidazol-2-yl)-2H-benzimidazole

C11H10N4 — CID 134947084

IUPAC5-(1-methylimidazol-2-yl)-2H-benzimidazole
SMILESCn1ccnc1-c1ccc2c(c1)=NCN=2
InChIInChI=1S/C11H10N4/c1-15-5-4-12-11(15)8-2-3-9-10(6-8)14-7-13-9/h2-6H,7H2,1H3
InChIKeySLURKVIOACBICB-UHFFFAOYSA-N
MW198.23 g/mol
LogP0.30
Rot. Bonds1

About 5-(1-methylimidazol-2-yl)-2H-benzimidazole

5-(1-methylimidazol-2-yl)-2H-benzimidazole (PubChem CID 134947084) has the molecular formula C11H10N4 and a molecular weight of 198.23 g/mol. Its IUPAC name is 5-(1-methylimidazol-2-yl)-2H-benzimidazole.

Molecular Properties

Compound Name5-(1-methylimidazol-2-yl)-2H-benzimidazole
PubChem CID134947084
Molecular FormulaC11H10N4
Molecular Weight198.23 g/mol
Exact Mass198.09
IUPAC Name5-(1-methylimidazol-2-yl)-2H-benzimidazole
SMILESCn1ccnc1-c1ccc2c(c1)=NCN=2
InChIInChI=1S/C11H10N4/c1-15-5-4-12-11(15)8-2-3-9-10(6-8)14-7-13-9/h2-6H,7H2,1H3
InChIKeySLURKVIOACBICB-UHFFFAOYSA-N
XLogP0.30
TPSA42.54 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.23
LogP ≤ 50.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 5-(1-methylimidazol-2-yl)-2H-benzimidazole?
The IUPAC name of 5-(1-methylimidazol-2-yl)-2H-benzimidazole (CID 134947084) is 5-(1-methylimidazol-2-yl)-2H-benzimidazole.
What is the SMILES notation for 5-(1-methylimidazol-2-yl)-2H-benzimidazole?
The canonical SMILES for 5-(1-methylimidazol-2-yl)-2H-benzimidazole is Cn1ccnc1-c1ccc2c(c1)=NCN=2.
What is the InChIKey of 5-(1-methylimidazol-2-yl)-2H-benzimidazole?
The InChIKey is SLURKVIOACBICB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4/c1-15-5-4-12-11(15)8-2-3-9-10(6-8)14-7-13-9/h2-6H,7H2,1H3.
What are the key properties of 5-(1-methylimidazol-2-yl)-2H-benzimidazole?
5-(1-methylimidazol-2-yl)-2H-benzimidazole has a molecular weight of 198.23 g/mol, XLogP of 0.30, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methylimidazol-2-yl)-2H-benzimidazole is sourced from PubChem (CID 134947084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).