1,2,4,6-tetramethylbenzimidazole

C11H14N2 — CID 58565379

IUPAC1,2,4,6-tetramethylbenzimidazole
SMILESCc1cc(C)c2nc(C)n(C)c2c1
InChIInChI=1S/C11H14N2/c1-7-5-8(2)11-10(6-7)13(4)9(3)12-11/h5-6H,1-4H3
InChIKeyDHVDHHBMJZQJGF-UHFFFAOYSA-N
MW174.25 g/mol
LogP2.50
Rot. Bonds

About 1,2,4,6-tetramethylbenzimidazole

1,2,4,6-tetramethylbenzimidazole (PubChem CID 58565379) has the molecular formula C11H14N2 and a molecular weight of 174.25 g/mol. Its IUPAC name is 1,2,4,6-tetramethylbenzimidazole.

Molecular Properties

Compound Name1,2,4,6-tetramethylbenzimidazole
PubChem CID58565379
Molecular FormulaC11H14N2
Molecular Weight174.25 g/mol
Exact Mass174.12
IUPAC Name1,2,4,6-tetramethylbenzimidazole
SMILESCc1cc(C)c2nc(C)n(C)c2c1
InChIInChI=1S/C11H14N2/c1-7-5-8(2)11-10(6-7)13(4)9(3)12-11/h5-6H,1-4H3
InChIKeyDHVDHHBMJZQJGF-UHFFFAOYSA-N
XLogP2.50
TPSA17.82 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 ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(1,2,6-trimethylbenzimidazol-4-yl)methanol
CID 155004907
2,2-dimethyl-3-(1,4,6-trimethylbenzimidazol-2-yl)propanoic acid
CID 84638251
4,6-dichloro-1,2-dimethylimidazo[4,5-c]pyridine
CID 163273340
5-bromo-1,2,6-trimethylbenzimidazol-4-amine
CID 10445004
CID 167500870
CID 167500870
6-bromo-4-fluoro-1,2-dimethylbenzimidazole
CID 146232538
lithium 5-(2,4,6-trimethylbenzimidazol-1-yl)pentanoate
CID 165382455
1-(2-methoxyethyl)-4,6-dimethylbenzimidazol-2-amine
CID 91671831
2-(2,3,5,7-tetramethylimidazo[1,2-a]benzimidazol-1-yl)acetic acid
CID 84641648
ethane;2,5,7-trimethylindazole
CID 156845071
potassium;1-methanidylphosphanyl-4-(2,4,6-trimethylbenzimidazol-1-yl)butan-1-one;vanadium
CID 167643136
2-(2,3-dimethylimidazo[4,5-b]pyridin-7-yl)-4,6-dimethylphenol
CID 170038842

Frequently Asked Questions

What is the IUPAC name of 1,2,4,6-tetramethylbenzimidazole?
The IUPAC name of 1,2,4,6-tetramethylbenzimidazole (CID 58565379) is 1,2,4,6-tetramethylbenzimidazole.
What is the SMILES notation for 1,2,4,6-tetramethylbenzimidazole?
The canonical SMILES for 1,2,4,6-tetramethylbenzimidazole is Cc1cc(C)c2nc(C)n(C)c2c1.
What is the InChIKey of 1,2,4,6-tetramethylbenzimidazole?
The InChIKey is DHVDHHBMJZQJGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2/c1-7-5-8(2)11-10(6-7)13(4)9(3)12-11/h5-6H,1-4H3.
What are the key properties of 1,2,4,6-tetramethylbenzimidazole?
1,2,4,6-tetramethylbenzimidazole has a molecular weight of 174.25 g/mol, XLogP of 2.50, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,4,6-tetramethylbenzimidazole is sourced from PubChem (CID 58565379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).