4,5,6,7-tetramethyl-2H-benzimidazole

C11H14N2 — CID 21034549

IUPAC4,5,6,7-tetramethyl-2H-benzimidazole
SMILESCc1c(C)c(C)c2c(c1C)=NCN=2
InChIInChI=1S/C11H14N2/c1-6-7(2)9(4)11-10(8(6)3)12-5-13-11/h5H2,1-4H3
InChIKeyDOJYVNBQLUSTAR-UHFFFAOYSA-N
MW174.25 g/mol
LogP1.13
Rot. Bonds

About 4,5,6,7-tetramethyl-2H-benzimidazole

4,5,6,7-tetramethyl-2H-benzimidazole (PubChem CID 21034549) has the molecular formula C11H14N2 and a molecular weight of 174.25 g/mol. Its IUPAC name is 4,5,6,7-tetramethyl-2H-benzimidazole.

Molecular Properties

Compound Name4,5,6,7-tetramethyl-2H-benzimidazole
PubChem CID21034549
Molecular FormulaC11H14N2
Molecular Weight174.25 g/mol
Exact Mass174.12
IUPAC Name4,5,6,7-tetramethyl-2H-benzimidazole
SMILESCc1c(C)c(C)c2c(c1C)=NCN=2
InChIInChI=1S/C11H14N2/c1-6-7(2)9(4)11-10(8(6)3)12-5-13-11/h5H2,1-4H3
InChIKeyDOJYVNBQLUSTAR-UHFFFAOYSA-N
XLogP1.13
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.25
LogP ≤ 51.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4,5,6,7-tetramethyl-2H-benzimidazole with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4,5,6,7-tetramethyl-2H-benzimidazole?
The IUPAC name of 4,5,6,7-tetramethyl-2H-benzimidazole (CID 21034549) is 4,5,6,7-tetramethyl-2H-benzimidazole.
What is the SMILES notation for 4,5,6,7-tetramethyl-2H-benzimidazole?
The canonical SMILES for 4,5,6,7-tetramethyl-2H-benzimidazole is Cc1c(C)c(C)c2c(c1C)=NCN=2.
What is the InChIKey of 4,5,6,7-tetramethyl-2H-benzimidazole?
The InChIKey is DOJYVNBQLUSTAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2/c1-6-7(2)9(4)11-10(8(6)3)12-5-13-11/h5H2,1-4H3.
What are the key properties of 4,5,6,7-tetramethyl-2H-benzimidazole?
4,5,6,7-tetramethyl-2H-benzimidazole has a molecular weight of 174.25 g/mol, XLogP of 1.13, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5,6,7-tetramethyl-2H-benzimidazole is sourced from PubChem (CID 21034549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).