2,6-dimethyl-4,9-dihydro-3H-benzo[f]benzimidazole

C13H14N2 — CID 89032192

IUPAC2,6-dimethyl-4,9-dihydro-3H-benzo[f]benzimidazole
SMILESCc1ccc2c(c1)Cc1[nH]c(C)nc1C2
InChIInChI=1S/C13H14N2/c1-8-3-4-10-6-12-13(7-11(10)5-8)15-9(2)14-12/h3-5H,6-7H2,1-2H3,(H,14,15)
InChIKeyJHUYDJNWNJCAJP-UHFFFAOYSA-N
MW198.27 g/mol
LogP2.52
Rot. Bonds

About 2,6-dimethyl-4,9-dihydro-3H-benzo[f]benzimidazole

2,6-dimethyl-4,9-dihydro-3H-benzo[f]benzimidazole (PubChem CID 89032192) has the molecular formula C13H14N2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 2,6-dimethyl-4,9-dihydro-3H-benzo[f]benzimidazole.

Molecular Properties

Compound Name2,6-dimethyl-4,9-dihydro-3H-benzo[f]benzimidazole
PubChem CID89032192
Molecular FormulaC13H14N2
Molecular Weight198.27 g/mol
Exact Mass198.12
IUPAC Name2,6-dimethyl-4,9-dihydro-3H-benzo[f]benzimidazole
SMILESCc1ccc2c(c1)Cc1[nH]c(C)nc1C2
InChIInChI=1S/C13H14N2/c1-8-3-4-10-6-12-13(7-11(10)5-8)15-9(2)14-12/h3-5H,6-7H2,1-2H3,(H,14,15)
InChIKeyJHUYDJNWNJCAJP-UHFFFAOYSA-N
XLogP2.52
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2,6-dimethyl-4,9-dihydro-3H-benzo[f]benzimidazole 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

7,17-dimethyl-2,12-diazapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1(13),2,4(9),5,7,11,14(19),15,17-nonaene
CID 143243946
2,2,5-trimethyl-1,3-dihydroisoindol-2-ium
CID 34243596
7-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine
CID 55264670
6-methyl-3-methylidene-2,4-dihydro-1H-naphthalene
CID 144794915
8-methyl-3-propan-2-yl-5,10-dihydrobenzo[g]isoquinoline
CID 70851519
(15Z)-6-methyltricyclo[9.6.0.03,8]heptadeca-1(11),3(8),4,6,15-pentaene
CID 142100998
10,27-dimethylnonacyclo[18.14.0.03,18.04,16.06,14.08,13.021,33.023,31.025,30]tetratriaconta-1,3(18),4,6(14),8(13),9,11,15,19,21,23(31),25(30),26,28,32-pentadecaene
CID 157144570
bis(2,7-dimethyl-9H-fluorene);ethane;methane
CID 159270379
6-methyl-1,2,3,4-tetrahydrophthalazine
CID 142250671
2-methyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine
CID 12037655
7-methyl-4,9-dihydro-1H-pyrazolo[4,5-b]quinoline
CID 82406176
2,7-dimethyl-9,10-dihydrophenanthrene
CID 23550290

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4,9-dihydro-3H-benzo[f]benzimidazole?
The IUPAC name of 2,6-dimethyl-4,9-dihydro-3H-benzo[f]benzimidazole (CID 89032192) is 2,6-dimethyl-4,9-dihydro-3H-benzo[f]benzimidazole.
What is the SMILES notation for 2,6-dimethyl-4,9-dihydro-3H-benzo[f]benzimidazole?
The canonical SMILES for 2,6-dimethyl-4,9-dihydro-3H-benzo[f]benzimidazole is Cc1ccc2c(c1)Cc1[nH]c(C)nc1C2.
What is the InChIKey of 2,6-dimethyl-4,9-dihydro-3H-benzo[f]benzimidazole?
The InChIKey is JHUYDJNWNJCAJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2/c1-8-3-4-10-6-12-13(7-11(10)5-8)15-9(2)14-12/h3-5H,6-7H2,1-2H3,(H,14,15).
What are the key properties of 2,6-dimethyl-4,9-dihydro-3H-benzo[f]benzimidazole?
2,6-dimethyl-4,9-dihydro-3H-benzo[f]benzimidazole has a molecular weight of 198.27 g/mol, XLogP of 2.52, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4,9-dihydro-3H-benzo[f]benzimidazole is sourced from PubChem (CID 89032192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).