2-methyl-1-(naphthalen-1-ylmethyl)imidazole

C15H14N2 — CID 2859675

IUPAC2-methyl-1-(naphthalen-1-ylmethyl)imidazole
SMILESCc1nccn1Cc1cccc2ccccc12
InChIInChI=1S/C15H14N2/c1-12-16-9-10-17(12)11-14-7-4-6-13-5-2-3-8-15(13)14/h2-10H,11H2,1H3
InChIKeyVRETZCZTEVEGME-UHFFFAOYSA-N
MW222.29 g/mol
LogP3.39
Rot. Bonds2

About 2-methyl-1-(naphthalen-1-ylmethyl)imidazole

2-methyl-1-(naphthalen-1-ylmethyl)imidazole (PubChem CID 2859675) has the molecular formula C15H14N2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 2-methyl-1-(naphthalen-1-ylmethyl)imidazole.

Molecular Properties

Compound Name2-methyl-1-(naphthalen-1-ylmethyl)imidazole
PubChem CID2859675
Molecular FormulaC15H14N2
Molecular Weight222.29 g/mol
Exact Mass222.12
IUPAC Name2-methyl-1-(naphthalen-1-ylmethyl)imidazole
SMILESCc1nccn1Cc1cccc2ccccc12
InChIInChI=1S/C15H14N2/c1-12-16-9-10-17(12)11-14-7-4-6-13-5-2-3-8-15(13)14/h2-10H,11H2,1H3
InChIKeyVRETZCZTEVEGME-UHFFFAOYSA-N
XLogP3.39
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(naphthalen-1-ylmethyl)imidazole?
The IUPAC name of 2-methyl-1-(naphthalen-1-ylmethyl)imidazole (CID 2859675) is 2-methyl-1-(naphthalen-1-ylmethyl)imidazole.
What is the SMILES notation for 2-methyl-1-(naphthalen-1-ylmethyl)imidazole?
The canonical SMILES for 2-methyl-1-(naphthalen-1-ylmethyl)imidazole is Cc1nccn1Cc1cccc2ccccc12.
What is the InChIKey of 2-methyl-1-(naphthalen-1-ylmethyl)imidazole?
The InChIKey is VRETZCZTEVEGME-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2/c1-12-16-9-10-17(12)11-14-7-4-6-13-5-2-3-8-15(13)14/h2-10H,11H2,1H3.
What are the key properties of 2-methyl-1-(naphthalen-1-ylmethyl)imidazole?
2-methyl-1-(naphthalen-1-ylmethyl)imidazole has a molecular weight of 222.29 g/mol, XLogP of 3.39, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(naphthalen-1-ylmethyl)imidazole is sourced from PubChem (CID 2859675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).