4-methyl-2-phenyl-1-pyridin-2-ylbenzimidazole

C19H15N3 — CID 58121833

IUPAC4-methyl-2-phenyl-1-pyridin-2-ylbenzimidazole
SMILESCc1cccc2c1nc(-c1ccccc1)n2-c1ccccn1
InChIInChI=1S/C19H15N3/c1-14-8-7-11-16-18(14)21-19(15-9-3-2-4-10-15)22(16)17-12-5-6-13-20-17/h2-13H,1H3
InChIKeyTUOTZWIMSVVDJQ-UHFFFAOYSA-N
MW285.35 g/mol
LogP4.40
Rot. Bonds2

About 4-methyl-2-phenyl-1-pyridin-2-ylbenzimidazole

4-methyl-2-phenyl-1-pyridin-2-ylbenzimidazole (PubChem CID 58121833) has the molecular formula C19H15N3 and a molecular weight of 285.35 g/mol. Its IUPAC name is 4-methyl-2-phenyl-1-pyridin-2-ylbenzimidazole.

Molecular Properties

Compound Name4-methyl-2-phenyl-1-pyridin-2-ylbenzimidazole
PubChem CID58121833
Molecular FormulaC19H15N3
Molecular Weight285.35 g/mol
Exact Mass285.13
IUPAC Name4-methyl-2-phenyl-1-pyridin-2-ylbenzimidazole
SMILESCc1cccc2c1nc(-c1ccccc1)n2-c1ccccn1
InChIInChI=1S/C19H15N3/c1-14-8-7-11-16-18(14)21-19(15-9-3-2-4-10-15)22(16)17-12-5-6-13-20-17/h2-13H,1H3
InChIKeyTUOTZWIMSVVDJQ-UHFFFAOYSA-N
XLogP4.40
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-phenyl-1-pyridin-2-ylbenzimidazole?
The IUPAC name of 4-methyl-2-phenyl-1-pyridin-2-ylbenzimidazole (CID 58121833) is 4-methyl-2-phenyl-1-pyridin-2-ylbenzimidazole.
What is the SMILES notation for 4-methyl-2-phenyl-1-pyridin-2-ylbenzimidazole?
The canonical SMILES for 4-methyl-2-phenyl-1-pyridin-2-ylbenzimidazole is Cc1cccc2c1nc(-c1ccccc1)n2-c1ccccn1.
What is the InChIKey of 4-methyl-2-phenyl-1-pyridin-2-ylbenzimidazole?
The InChIKey is TUOTZWIMSVVDJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3/c1-14-8-7-11-16-18(14)21-19(15-9-3-2-4-10-15)22(16)17-12-5-6-13-20-17/h2-13H,1H3.
What are the key properties of 4-methyl-2-phenyl-1-pyridin-2-ylbenzimidazole?
4-methyl-2-phenyl-1-pyridin-2-ylbenzimidazole has a molecular weight of 285.35 g/mol, XLogP of 4.40, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-phenyl-1-pyridin-2-ylbenzimidazole is sourced from PubChem (CID 58121833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).