2-propan-2-yl-1-(2-propan-2-ylphenyl)benzimidazole

C19H22N2 — CID 155173883

IUPAC2-propan-2-yl-1-(2-propan-2-ylphenyl)benzimidazole
SMILESCC(C)c1ccccc1-n1c(C(C)C)nc2ccccc21
InChIInChI=1S/C19H22N2/c1-13(2)15-9-5-7-11-17(15)21-18-12-8-6-10-16(18)20-19(21)14(3)4/h5-14H,1-4H3
InChIKeyNYSZLTNNUFWBJU-UHFFFAOYSA-N
MW278.40 g/mol
LogP5.27
Rot. Bonds3

About 2-propan-2-yl-1-(2-propan-2-ylphenyl)benzimidazole

2-propan-2-yl-1-(2-propan-2-ylphenyl)benzimidazole (PubChem CID 155173883) has the molecular formula C19H22N2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 2-propan-2-yl-1-(2-propan-2-ylphenyl)benzimidazole.

Molecular Properties

Compound Name2-propan-2-yl-1-(2-propan-2-ylphenyl)benzimidazole
PubChem CID155173883
Molecular FormulaC19H22N2
Molecular Weight278.40 g/mol
Exact Mass278.18
IUPAC Name2-propan-2-yl-1-(2-propan-2-ylphenyl)benzimidazole
SMILESCC(C)c1ccccc1-n1c(C(C)C)nc2ccccc21
InChIInChI=1S/C19H22N2/c1-13(2)15-9-5-7-11-17(15)21-18-12-8-6-10-16(18)20-19(21)14(3)4/h5-14H,1-4H3
InChIKeyNYSZLTNNUFWBJU-UHFFFAOYSA-N
XLogP5.27
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500278.40
LogP ≤ 55.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yl-1-(2-propan-2-ylphenyl)benzimidazole?
The IUPAC name of 2-propan-2-yl-1-(2-propan-2-ylphenyl)benzimidazole (CID 155173883) is 2-propan-2-yl-1-(2-propan-2-ylphenyl)benzimidazole.
What is the SMILES notation for 2-propan-2-yl-1-(2-propan-2-ylphenyl)benzimidazole?
The canonical SMILES for 2-propan-2-yl-1-(2-propan-2-ylphenyl)benzimidazole is CC(C)c1ccccc1-n1c(C(C)C)nc2ccccc21.
What is the InChIKey of 2-propan-2-yl-1-(2-propan-2-ylphenyl)benzimidazole?
The InChIKey is NYSZLTNNUFWBJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2/c1-13(2)15-9-5-7-11-17(15)21-18-12-8-6-10-16(18)20-19(21)14(3)4/h5-14H,1-4H3.
What are the key properties of 2-propan-2-yl-1-(2-propan-2-ylphenyl)benzimidazole?
2-propan-2-yl-1-(2-propan-2-ylphenyl)benzimidazole has a molecular weight of 278.40 g/mol, XLogP of 5.27, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-1-(2-propan-2-ylphenyl)benzimidazole is sourced from PubChem (CID 155173883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).