2-cyclohexyl-6-methyl-1H-benzimidazole

C14H18N2 — CID 6487592

IUPAC2-cyclohexyl-6-methyl-1H-benzimidazole
SMILESCc1ccc2nc(C3CCCCC3)[nH]c2c1
InChIInChI=1S/C14H18N2/c1-10-7-8-12-13(9-10)16-14(15-12)11-5-3-2-4-6-11/h7-9,11H,2-6H2,1H3,(H,15,16)
InChIKeyBTTUILOCKWTBFO-UHFFFAOYSA-N
MW214.31 g/mol
LogP3.92
Rot. Bonds1

About 2-cyclohexyl-6-methyl-1H-benzimidazole

2-cyclohexyl-6-methyl-1H-benzimidazole (PubChem CID 6487592) has the molecular formula C14H18N2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 2-cyclohexyl-6-methyl-1H-benzimidazole.

Molecular Properties

Compound Name2-cyclohexyl-6-methyl-1H-benzimidazole
PubChem CID6487592
Molecular FormulaC14H18N2
Molecular Weight214.31 g/mol
Exact Mass214.15
IUPAC Name2-cyclohexyl-6-methyl-1H-benzimidazole
SMILESCc1ccc2nc(C3CCCCC3)[nH]c2c1
InChIInChI=1S/C14H18N2/c1-10-7-8-12-13(9-10)16-14(15-12)11-5-3-2-4-6-11/h7-9,11H,2-6H2,1H3,(H,15,16)
InChIKeyBTTUILOCKWTBFO-UHFFFAOYSA-N
XLogP3.92
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-6-methyl-1H-benzimidazole?
The IUPAC name of 2-cyclohexyl-6-methyl-1H-benzimidazole (CID 6487592) is 2-cyclohexyl-6-methyl-1H-benzimidazole.
What is the SMILES notation for 2-cyclohexyl-6-methyl-1H-benzimidazole?
The canonical SMILES for 2-cyclohexyl-6-methyl-1H-benzimidazole is Cc1ccc2nc(C3CCCCC3)[nH]c2c1.
What is the InChIKey of 2-cyclohexyl-6-methyl-1H-benzimidazole?
The InChIKey is BTTUILOCKWTBFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2/c1-10-7-8-12-13(9-10)16-14(15-12)11-5-3-2-4-6-11/h7-9,11H,2-6H2,1H3,(H,15,16).
What are the key properties of 2-cyclohexyl-6-methyl-1H-benzimidazole?
2-cyclohexyl-6-methyl-1H-benzimidazole has a molecular weight of 214.31 g/mol, XLogP of 3.92, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-6-methyl-1H-benzimidazole is sourced from PubChem (CID 6487592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).