2,2,5,5-tetramethyl-4-phenyl-1H-imidazole

C13H18N2 — CID 604453

IUPAC2,2,5,5-tetramethyl-4-phenyl-1H-imidazole
SMILESCC1(C)N=C(c2ccccc2)C(C)(C)N1
InChIInChI=1S/C13H18N2/c1-12(2)11(14-13(3,4)15-12)10-8-6-5-7-9-10/h5-9,15H,1-4H3
InChIKeyHJMZJVYIMNRNSU-UHFFFAOYSA-N
MW202.30 g/mol
LogP2.59
Rot. Bonds1

About 2,2,5,5-tetramethyl-4-phenyl-1H-imidazole

2,2,5,5-tetramethyl-4-phenyl-1H-imidazole (PubChem CID 604453) has the molecular formula C13H18N2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 2,2,5,5-tetramethyl-4-phenyl-1H-imidazole.

Molecular Properties

Compound Name2,2,5,5-tetramethyl-4-phenyl-1H-imidazole
PubChem CID604453
Molecular FormulaC13H18N2
Molecular Weight202.30 g/mol
Exact Mass202.15
IUPAC Name2,2,5,5-tetramethyl-4-phenyl-1H-imidazole
SMILESCC1(C)N=C(c2ccccc2)C(C)(C)N1
InChIInChI=1S/C13H18N2/c1-12(2)11(14-13(3,4)15-12)10-8-6-5-7-9-10/h5-9,15H,1-4H3
InChIKeyHJMZJVYIMNRNSU-UHFFFAOYSA-N
XLogP2.59
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2,5,5-tetramethyl-4-phenyl-1H-imidazole?
The IUPAC name of 2,2,5,5-tetramethyl-4-phenyl-1H-imidazole (CID 604453) is 2,2,5,5-tetramethyl-4-phenyl-1H-imidazole.
What is the SMILES notation for 2,2,5,5-tetramethyl-4-phenyl-1H-imidazole?
The canonical SMILES for 2,2,5,5-tetramethyl-4-phenyl-1H-imidazole is CC1(C)N=C(c2ccccc2)C(C)(C)N1.
What is the InChIKey of 2,2,5,5-tetramethyl-4-phenyl-1H-imidazole?
The InChIKey is HJMZJVYIMNRNSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2/c1-12(2)11(14-13(3,4)15-12)10-8-6-5-7-9-10/h5-9,15H,1-4H3.
What are the key properties of 2,2,5,5-tetramethyl-4-phenyl-1H-imidazole?
2,2,5,5-tetramethyl-4-phenyl-1H-imidazole has a molecular weight of 202.30 g/mol, XLogP of 2.59, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,5,5-tetramethyl-4-phenyl-1H-imidazole is sourced from PubChem (CID 604453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).