2-methyl-1-(2-phenylethyl)benzimidazole

C16H16N2 — CID 763570

IUPAC2-methyl-1-(2-phenylethyl)benzimidazole
SMILESCc1nc2ccccc2n1CCc1ccccc1
InChIInChI=1S/C16H16N2/c1-13-17-15-9-5-6-10-16(15)18(13)12-11-14-7-3-2-4-8-14/h2-10H,11-12H2,1H3
InChIKeyHUOSRLKHQQNGGL-UHFFFAOYSA-N
MW236.32 g/mol
LogP3.59
Rot. Bonds3

About 2-methyl-1-(2-phenylethyl)benzimidazole

2-methyl-1-(2-phenylethyl)benzimidazole (PubChem CID 763570) has the molecular formula C16H16N2 and a molecular weight of 236.32 g/mol. Its IUPAC name is 2-methyl-1-(2-phenylethyl)benzimidazole.

Molecular Properties

Compound Name2-methyl-1-(2-phenylethyl)benzimidazole
PubChem CID763570
Molecular FormulaC16H16N2
Molecular Weight236.32 g/mol
Exact Mass236.13
IUPAC Name2-methyl-1-(2-phenylethyl)benzimidazole
SMILESCc1nc2ccccc2n1CCc1ccccc1
InChIInChI=1S/C16H16N2/c1-13-17-15-9-5-6-10-16(15)18(13)12-11-14-7-3-2-4-8-14/h2-10H,11-12H2,1H3
InChIKeyHUOSRLKHQQNGGL-UHFFFAOYSA-N
XLogP3.59
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(2-phenylethyl)benzimidazole?
The IUPAC name of 2-methyl-1-(2-phenylethyl)benzimidazole (CID 763570) is 2-methyl-1-(2-phenylethyl)benzimidazole.
What is the SMILES notation for 2-methyl-1-(2-phenylethyl)benzimidazole?
The canonical SMILES for 2-methyl-1-(2-phenylethyl)benzimidazole is Cc1nc2ccccc2n1CCc1ccccc1.
What is the InChIKey of 2-methyl-1-(2-phenylethyl)benzimidazole?
The InChIKey is HUOSRLKHQQNGGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2/c1-13-17-15-9-5-6-10-16(15)18(13)12-11-14-7-3-2-4-8-14/h2-10H,11-12H2,1H3.
What are the key properties of 2-methyl-1-(2-phenylethyl)benzimidazole?
2-methyl-1-(2-phenylethyl)benzimidazole has a molecular weight of 236.32 g/mol, XLogP of 3.59, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(2-phenylethyl)benzimidazole is sourced from PubChem (CID 763570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).