2-phenyl-4-propylimidazo[1,2-a]benzimidazole

C18H17N3 — CID 799630

IUPAC2-phenyl-4-propylimidazo[1,2-a]benzimidazole
SMILESCCCn1c2ccccc2n2cc(-c3ccccc3)nc12
InChIInChI=1S/C18H17N3/c1-2-12-20-16-10-6-7-11-17(16)21-13-15(19-18(20)21)14-8-4-3-5-9-14/h3-11,13H,2,12H2,1H3
InChIKeyDUUAZFLGKUNAIY-UHFFFAOYSA-N
MW275.36 g/mol
LogP4.37
Rot. Bonds3

About 2-phenyl-4-propylimidazo[1,2-a]benzimidazole

2-phenyl-4-propylimidazo[1,2-a]benzimidazole (PubChem CID 799630) has the molecular formula C18H17N3 and a molecular weight of 275.36 g/mol. Its IUPAC name is 2-phenyl-4-propylimidazo[1,2-a]benzimidazole.

Molecular Properties

Compound Name2-phenyl-4-propylimidazo[1,2-a]benzimidazole
PubChem CID799630
Molecular FormulaC18H17N3
Molecular Weight275.36 g/mol
Exact Mass275.14
IUPAC Name2-phenyl-4-propylimidazo[1,2-a]benzimidazole
SMILESCCCn1c2ccccc2n2cc(-c3ccccc3)nc12
InChIInChI=1S/C18H17N3/c1-2-12-20-16-10-6-7-11-17(16)21-13-15(19-18(20)21)14-8-4-3-5-9-14/h3-11,13H,2,12H2,1H3
InChIKeyDUUAZFLGKUNAIY-UHFFFAOYSA-N
XLogP4.37
TPSA22.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-4-propylimidazo[1,2-a]benzimidazole?
The IUPAC name of 2-phenyl-4-propylimidazo[1,2-a]benzimidazole (CID 799630) is 2-phenyl-4-propylimidazo[1,2-a]benzimidazole.
What is the SMILES notation for 2-phenyl-4-propylimidazo[1,2-a]benzimidazole?
The canonical SMILES for 2-phenyl-4-propylimidazo[1,2-a]benzimidazole is CCCn1c2ccccc2n2cc(-c3ccccc3)nc12.
What is the InChIKey of 2-phenyl-4-propylimidazo[1,2-a]benzimidazole?
The InChIKey is DUUAZFLGKUNAIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3/c1-2-12-20-16-10-6-7-11-17(16)21-13-15(19-18(20)21)14-8-4-3-5-9-14/h3-11,13H,2,12H2,1H3.
What are the key properties of 2-phenyl-4-propylimidazo[1,2-a]benzimidazole?
2-phenyl-4-propylimidazo[1,2-a]benzimidazole has a molecular weight of 275.36 g/mol, XLogP of 4.37, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-4-propylimidazo[1,2-a]benzimidazole is sourced from PubChem (CID 799630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).