5-(2-methylcyclopropyl)-1H-imidazole

C7H10N2 — CID 72588094

IUPAC5-(2-methylcyclopropyl)-1H-imidazole
SMILESCC1CC1c1cnc[nH]1
InChIInChI=1S/C7H10N2/c1-5-2-6(5)7-3-8-4-9-7/h3-6H,2H2,1H3,(H,8,9)
InChIKeyRRXYYDSSUPGLOI-UHFFFAOYSA-N
MW122.17 g/mol
LogP1.53
Rot. Bonds1

About 5-(2-methylcyclopropyl)-1H-imidazole

5-(2-methylcyclopropyl)-1H-imidazole (PubChem CID 72588094) has the molecular formula C7H10N2 and a molecular weight of 122.17 g/mol. Its IUPAC name is 5-(2-methylcyclopropyl)-1H-imidazole.

Molecular Properties

Compound Name5-(2-methylcyclopropyl)-1H-imidazole
PubChem CID72588094
Molecular FormulaC7H10N2
Molecular Weight122.17 g/mol
Exact Mass122.08
IUPAC Name5-(2-methylcyclopropyl)-1H-imidazole
SMILESCC1CC1c1cnc[nH]1
InChIInChI=1S/C7H10N2/c1-5-2-6(5)7-3-8-4-9-7/h3-6H,2H2,1H3,(H,8,9)
InChIKeyRRXYYDSSUPGLOI-UHFFFAOYSA-N
XLogP1.53
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.17
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-(2-methylcyclopropyl)-1H-imidazole?
The IUPAC name of 5-(2-methylcyclopropyl)-1H-imidazole (CID 72588094) is 5-(2-methylcyclopropyl)-1H-imidazole.
What is the SMILES notation for 5-(2-methylcyclopropyl)-1H-imidazole?
The canonical SMILES for 5-(2-methylcyclopropyl)-1H-imidazole is CC1CC1c1cnc[nH]1.
What is the InChIKey of 5-(2-methylcyclopropyl)-1H-imidazole?
The InChIKey is RRXYYDSSUPGLOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2/c1-5-2-6(5)7-3-8-4-9-7/h3-6H,2H2,1H3,(H,8,9).
What are the key properties of 5-(2-methylcyclopropyl)-1H-imidazole?
5-(2-methylcyclopropyl)-1H-imidazole has a molecular weight of 122.17 g/mol, XLogP of 1.53, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methylcyclopropyl)-1H-imidazole is sourced from PubChem (CID 72588094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).