1-benzyl-2-pyridin-2-ylbenzimidazole

C19H15N3 — CID 797337

IUPAC1-benzyl-2-pyridin-2-ylbenzimidazole
SMILESc1ccc(Cn2c(-c3ccccn3)nc3ccccc32)cc1
InChIInChI=1S/C19H15N3/c1-2-8-15(9-3-1)14-22-18-12-5-4-10-16(18)21-19(22)17-11-6-7-13-20-17/h1-13H,14H2
InChIKeyXBAHLDPYUIFKLE-UHFFFAOYSA-N
MW285.35 g/mol
LogP4.15
Rot. Bonds3

About 1-benzyl-2-pyridin-2-ylbenzimidazole

1-benzyl-2-pyridin-2-ylbenzimidazole (PubChem CID 797337) has the molecular formula C19H15N3 and a molecular weight of 285.35 g/mol. Its IUPAC name is 1-benzyl-2-pyridin-2-ylbenzimidazole.

Molecular Properties

Compound Name1-benzyl-2-pyridin-2-ylbenzimidazole
PubChem CID797337
Molecular FormulaC19H15N3
Molecular Weight285.35 g/mol
Exact Mass285.13
IUPAC Name1-benzyl-2-pyridin-2-ylbenzimidazole
SMILESc1ccc(Cn2c(-c3ccccn3)nc3ccccc32)cc1
InChIInChI=1S/C19H15N3/c1-2-8-15(9-3-1)14-22-18-12-5-4-10-16(18)21-19(22)17-11-6-7-13-20-17/h1-13H,14H2
InChIKeyXBAHLDPYUIFKLE-UHFFFAOYSA-N
XLogP4.15
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

CID 1530
CID 1530
CID 65997
CID 65997
CID 49970
CID 49970
CID 49971
CID 49971
CID 11256587
CID 11256587
CID 71821
CID 71821
CID 123618
CID 123618
CID 16659285
CID 16659285
CID 53262401
CID 53262401
CID 5025739
CID 5025739
CID 201134
CID 201134
CID 70821
CID 70821

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-2-pyridin-2-ylbenzimidazole?
The IUPAC name of 1-benzyl-2-pyridin-2-ylbenzimidazole (CID 797337) is 1-benzyl-2-pyridin-2-ylbenzimidazole.
What is the SMILES notation for 1-benzyl-2-pyridin-2-ylbenzimidazole?
The canonical SMILES for 1-benzyl-2-pyridin-2-ylbenzimidazole is c1ccc(Cn2c(-c3ccccn3)nc3ccccc32)cc1.
What is the InChIKey of 1-benzyl-2-pyridin-2-ylbenzimidazole?
The InChIKey is XBAHLDPYUIFKLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3/c1-2-8-15(9-3-1)14-22-18-12-5-4-10-16(18)21-19(22)17-11-6-7-13-20-17/h1-13H,14H2.
What are the key properties of 1-benzyl-2-pyridin-2-ylbenzimidazole?
1-benzyl-2-pyridin-2-ylbenzimidazole has a molecular weight of 285.35 g/mol, XLogP of 4.15, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-2-pyridin-2-ylbenzimidazole is sourced from PubChem (CID 797337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).