5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole

C14H12N4 — CID 118069511

IUPAC5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole
SMILESCc1cc2c3c(c(C)cc2c2c1=NCN=2)=NCN=3
InChIInChI=1S/C14H12N4/c1-7-3-9-10(13-11(7)15-5-17-13)4-8(2)12-14(9)18-6-16-12/h3-4H,5-6H2,1-2H3
InChIKeyLHGCUSAMTGPSLR-UHFFFAOYSA-N
MW236.28 g/mol
LogP-0.12
Rot. Bonds

About 5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole

5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole (PubChem CID 118069511) has the molecular formula C14H12N4 and a molecular weight of 236.28 g/mol. Its IUPAC name is 5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole.

Molecular Properties

Compound Name5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole
PubChem CID118069511
Molecular FormulaC14H12N4
Molecular Weight236.28 g/mol
Exact Mass236.11
IUPAC Name5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole
SMILESCc1cc2c3c(c(C)cc2c2c1=NCN=2)=NCN=3
InChIInChI=1S/C14H12N4/c1-7-3-9-10(13-11(7)15-5-17-13)4-8(2)12-14(9)18-6-16-12/h3-4H,5-6H2,1-2H3
InChIKeyLHGCUSAMTGPSLR-UHFFFAOYSA-N
XLogP-0.12
TPSA49.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.28
LogP ≤ 5-0.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole?
The IUPAC name of 5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole (CID 118069511) is 5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole.
What is the SMILES notation for 5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole?
The canonical SMILES for 5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole is Cc1cc2c3c(c(C)cc2c2c1=NCN=2)=NCN=3.
What is the InChIKey of 5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole?
The InChIKey is LHGCUSAMTGPSLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4/c1-7-3-9-10(13-11(7)15-5-17-13)4-8(2)12-14(9)18-6-16-12/h3-4H,5-6H2,1-2H3.
What are the key properties of 5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole?
5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole has a molecular weight of 236.28 g/mol, XLogP of -0.12, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,10-dimethyl-2,7-dihydrobenzimidazolo[5,4-e]benzimidazole is sourced from PubChem (CID 118069511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).