5-(5-methyl-1-bicyclo[3.1.0]hexanyl)-1H-imidazole

C10H14N2 — CID 130291700

IUPAC5-(5-methyl-1-bicyclo[3.1.0]hexanyl)-1H-imidazole
SMILESCC12CCCC1(c1cnc[nH]1)C2
InChIInChI=1S/C10H14N2/c1-9-3-2-4-10(9,6-9)8-5-11-7-12-8/h5,7H,2-4,6H2,1H3,(H,11,12)
InChIKeyOEVRAVXFFXKOJR-UHFFFAOYSA-N
MW162.24 g/mol
LogP2.24
Rot. Bonds1

About 5-(5-methyl-1-bicyclo[3.1.0]hexanyl)-1H-imidazole

5-(5-methyl-1-bicyclo[3.1.0]hexanyl)-1H-imidazole (PubChem CID 130291700) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is 5-(5-methyl-1-bicyclo[3.1.0]hexanyl)-1H-imidazole.

Molecular Properties

Compound Name5-(5-methyl-1-bicyclo[3.1.0]hexanyl)-1H-imidazole
PubChem CID130291700
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC Name5-(5-methyl-1-bicyclo[3.1.0]hexanyl)-1H-imidazole
SMILESCC12CCCC1(c1cnc[nH]1)C2
InChIInChI=1S/C10H14N2/c1-9-3-2-4-10(9,6-9)8-5-11-7-12-8/h5,7H,2-4,6H2,1H3,(H,11,12)
InChIKeyOEVRAVXFFXKOJR-UHFFFAOYSA-N
XLogP2.24
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-(5-methyl-1-bicyclo[3.1.0]hexanyl)-1H-imidazole?
The IUPAC name of 5-(5-methyl-1-bicyclo[3.1.0]hexanyl)-1H-imidazole (CID 130291700) is 5-(5-methyl-1-bicyclo[3.1.0]hexanyl)-1H-imidazole.
What is the SMILES notation for 5-(5-methyl-1-bicyclo[3.1.0]hexanyl)-1H-imidazole?
The canonical SMILES for 5-(5-methyl-1-bicyclo[3.1.0]hexanyl)-1H-imidazole is CC12CCCC1(c1cnc[nH]1)C2.
What is the InChIKey of 5-(5-methyl-1-bicyclo[3.1.0]hexanyl)-1H-imidazole?
The InChIKey is OEVRAVXFFXKOJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2/c1-9-3-2-4-10(9,6-9)8-5-11-7-12-8/h5,7H,2-4,6H2,1H3,(H,11,12).
What are the key properties of 5-(5-methyl-1-bicyclo[3.1.0]hexanyl)-1H-imidazole?
5-(5-methyl-1-bicyclo[3.1.0]hexanyl)-1H-imidazole has a molecular weight of 162.24 g/mol, XLogP of 2.24, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-methyl-1-bicyclo[3.1.0]hexanyl)-1H-imidazole is sourced from PubChem (CID 130291700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).