2-(2-butan-2-ylphenyl)-1-methyl-4,5-dihydroimidazole

C14H20N2 — CID 144582436

IUPAC2-(2-butan-2-ylphenyl)-1-methyl-4,5-dihydroimidazole
SMILESCCC(C)c1ccccc1C1=NCCN1C
InChIInChI=1S/C14H20N2/c1-4-11(2)12-7-5-6-8-13(12)14-15-9-10-16(14)3/h5-8,11H,4,9-10H2,1-3H3
InChIKeyYWPDXBKHHGFCHR-UHFFFAOYSA-N
MW216.33 g/mol
LogP2.89
Rot. Bonds3

About 2-(2-butan-2-ylphenyl)-1-methyl-4,5-dihydroimidazole

2-(2-butan-2-ylphenyl)-1-methyl-4,5-dihydroimidazole (PubChem CID 144582436) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is 2-(2-butan-2-ylphenyl)-1-methyl-4,5-dihydroimidazole.

Molecular Properties

Compound Name2-(2-butan-2-ylphenyl)-1-methyl-4,5-dihydroimidazole
PubChem CID144582436
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC Name2-(2-butan-2-ylphenyl)-1-methyl-4,5-dihydroimidazole
SMILESCCC(C)c1ccccc1C1=NCCN1C
InChIInChI=1S/C14H20N2/c1-4-11(2)12-7-5-6-8-13(12)14-15-9-10-16(14)3/h5-8,11H,4,9-10H2,1-3H3
InChIKeyYWPDXBKHHGFCHR-UHFFFAOYSA-N
XLogP2.89
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-butan-2-ylphenyl)-1-methyl-4,5-dihydroimidazole?
The IUPAC name of 2-(2-butan-2-ylphenyl)-1-methyl-4,5-dihydroimidazole (CID 144582436) is 2-(2-butan-2-ylphenyl)-1-methyl-4,5-dihydroimidazole.
What is the SMILES notation for 2-(2-butan-2-ylphenyl)-1-methyl-4,5-dihydroimidazole?
The canonical SMILES for 2-(2-butan-2-ylphenyl)-1-methyl-4,5-dihydroimidazole is CCC(C)c1ccccc1C1=NCCN1C.
What is the InChIKey of 2-(2-butan-2-ylphenyl)-1-methyl-4,5-dihydroimidazole?
The InChIKey is YWPDXBKHHGFCHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c1-4-11(2)12-7-5-6-8-13(12)14-15-9-10-16(14)3/h5-8,11H,4,9-10H2,1-3H3.
What are the key properties of 2-(2-butan-2-ylphenyl)-1-methyl-4,5-dihydroimidazole?
2-(2-butan-2-ylphenyl)-1-methyl-4,5-dihydroimidazole has a molecular weight of 216.33 g/mol, XLogP of 2.89, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-butan-2-ylphenyl)-1-methyl-4,5-dihydroimidazole is sourced from PubChem (CID 144582436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).