2-methyl-5-(2-methyl-1H-imidazol-5-yl)-1H-imidazole

C8H10N4 — CID 11030144

IUPAC2-methyl-5-(2-methyl-1H-imidazol-5-yl)-1H-imidazole
SMILESCc1ncc(-c2cnc(C)[nH]2)[nH]1
InChIInChI=1S/C8H10N4/c1-5-9-3-7(11-5)8-4-10-6(2)12-8/h3-4H,1-2H3,(H,9,11)(H,10,12)
InChIKeySPWHQKMFDHRGQD-UHFFFAOYSA-N
MW162.20 g/mol
LogP1.42
Rot. Bonds1

About 2-methyl-5-(2-methyl-1H-imidazol-5-yl)-1H-imidazole

2-methyl-5-(2-methyl-1H-imidazol-5-yl)-1H-imidazole (PubChem CID 11030144) has the molecular formula C8H10N4 and a molecular weight of 162.20 g/mol. Its IUPAC name is 2-methyl-5-(2-methyl-1H-imidazol-5-yl)-1H-imidazole.

Molecular Properties

Compound Name2-methyl-5-(2-methyl-1H-imidazol-5-yl)-1H-imidazole
PubChem CID11030144
Molecular FormulaC8H10N4
Molecular Weight162.20 g/mol
Exact Mass162.09
IUPAC Name2-methyl-5-(2-methyl-1H-imidazol-5-yl)-1H-imidazole
SMILESCc1ncc(-c2cnc(C)[nH]2)[nH]1
InChIInChI=1S/C8H10N4/c1-5-9-3-7(11-5)8-4-10-6(2)12-8/h3-4H,1-2H3,(H,9,11)(H,10,12)
InChIKeySPWHQKMFDHRGQD-UHFFFAOYSA-N
XLogP1.42
TPSA57.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.20
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(2-methyl-1H-imidazol-5-yl)-1H-imidazole?
The IUPAC name of 2-methyl-5-(2-methyl-1H-imidazol-5-yl)-1H-imidazole (CID 11030144) is 2-methyl-5-(2-methyl-1H-imidazol-5-yl)-1H-imidazole.
What is the SMILES notation for 2-methyl-5-(2-methyl-1H-imidazol-5-yl)-1H-imidazole?
The canonical SMILES for 2-methyl-5-(2-methyl-1H-imidazol-5-yl)-1H-imidazole is Cc1ncc(-c2cnc(C)[nH]2)[nH]1.
What is the InChIKey of 2-methyl-5-(2-methyl-1H-imidazol-5-yl)-1H-imidazole?
The InChIKey is SPWHQKMFDHRGQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4/c1-5-9-3-7(11-5)8-4-10-6(2)12-8/h3-4H,1-2H3,(H,9,11)(H,10,12).
What are the key properties of 2-methyl-5-(2-methyl-1H-imidazol-5-yl)-1H-imidazole?
2-methyl-5-(2-methyl-1H-imidazol-5-yl)-1H-imidazole has a molecular weight of 162.20 g/mol, XLogP of 1.42, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(2-methyl-1H-imidazol-5-yl)-1H-imidazole is sourced from PubChem (CID 11030144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).