2-(2,2-dimethylcyclopentyl)-6-methyl-4,5,6,7-tetrahydro-1H-benzimidazole

C15H24N2 — CID 107186427

IUPAC2-(2,2-dimethylcyclopentyl)-6-methyl-4,5,6,7-tetrahydro-1H-benzimidazole
SMILESCC1CCc2nc(C3CCCC3(C)C)[nH]c2C1
InChIInChI=1S/C15H24N2/c1-10-6-7-12-13(9-10)17-14(16-12)11-5-4-8-15(11,2)3/h10-11H,4-9H2,1-3H3,(H,16,17)
InChIKeyMWVRREINCKEXBW-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.83
Rot. Bonds1

About 2-(2,2-dimethylcyclopentyl)-6-methyl-4,5,6,7-tetrahydro-1H-benzimidazole

2-(2,2-dimethylcyclopentyl)-6-methyl-4,5,6,7-tetrahydro-1H-benzimidazole (PubChem CID 107186427) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 2-(2,2-dimethylcyclopentyl)-6-methyl-4,5,6,7-tetrahydro-1H-benzimidazole.

Molecular Properties

Compound Name2-(2,2-dimethylcyclopentyl)-6-methyl-4,5,6,7-tetrahydro-1H-benzimidazole
PubChem CID107186427
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name2-(2,2-dimethylcyclopentyl)-6-methyl-4,5,6,7-tetrahydro-1H-benzimidazole
SMILESCC1CCc2nc(C3CCCC3(C)C)[nH]c2C1
InChIInChI=1S/C15H24N2/c1-10-6-7-12-13(9-10)17-14(16-12)11-5-4-8-15(11,2)3/h10-11H,4-9H2,1-3H3,(H,16,17)
InChIKeyMWVRREINCKEXBW-UHFFFAOYSA-N
XLogP3.83
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethylcyclopentyl)-6-methyl-4,5,6,7-tetrahydro-1H-benzimidazole?
The IUPAC name of 2-(2,2-dimethylcyclopentyl)-6-methyl-4,5,6,7-tetrahydro-1H-benzimidazole (CID 107186427) is 2-(2,2-dimethylcyclopentyl)-6-methyl-4,5,6,7-tetrahydro-1H-benzimidazole.
What is the SMILES notation for 2-(2,2-dimethylcyclopentyl)-6-methyl-4,5,6,7-tetrahydro-1H-benzimidazole?
The canonical SMILES for 2-(2,2-dimethylcyclopentyl)-6-methyl-4,5,6,7-tetrahydro-1H-benzimidazole is CC1CCc2nc(C3CCCC3(C)C)[nH]c2C1.
What is the InChIKey of 2-(2,2-dimethylcyclopentyl)-6-methyl-4,5,6,7-tetrahydro-1H-benzimidazole?
The InChIKey is MWVRREINCKEXBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-10-6-7-12-13(9-10)17-14(16-12)11-5-4-8-15(11,2)3/h10-11H,4-9H2,1-3H3,(H,16,17).
What are the key properties of 2-(2,2-dimethylcyclopentyl)-6-methyl-4,5,6,7-tetrahydro-1H-benzimidazole?
2-(2,2-dimethylcyclopentyl)-6-methyl-4,5,6,7-tetrahydro-1H-benzimidazole has a molecular weight of 232.37 g/mol, XLogP of 3.83, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylcyclopentyl)-6-methyl-4,5,6,7-tetrahydro-1H-benzimidazole is sourced from PubChem (CID 107186427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).