1,3-bis(2-phenylethyl)-2H-benzimidazole

C23H24N2 — CID 510027

IUPAC1,3-bis(2-phenylethyl)-2H-benzimidazole
SMILESc1ccc(CCN2CN(CCc3ccccc3)c3ccccc32)cc1
InChIInChI=1S/C23H24N2/c1-3-9-20(10-4-1)15-17-24-19-25(23-14-8-7-13-22(23)24)18-16-21-11-5-2-6-12-21/h1-14H,15-19H2
InChIKeyNMNOTNOPXAWHGL-UHFFFAOYSA-N
MW328.46 g/mol
LogP4.76
Rot. Bonds6

About 1,3-bis(2-phenylethyl)-2H-benzimidazole

1,3-bis(2-phenylethyl)-2H-benzimidazole (PubChem CID 510027) has the molecular formula C23H24N2 and a molecular weight of 328.46 g/mol. Its IUPAC name is 1,3-bis(2-phenylethyl)-2H-benzimidazole.

Molecular Properties

Compound Name1,3-bis(2-phenylethyl)-2H-benzimidazole
PubChem CID510027
Molecular FormulaC23H24N2
Molecular Weight328.46 g/mol
Exact Mass328.19
IUPAC Name1,3-bis(2-phenylethyl)-2H-benzimidazole
SMILESc1ccc(CCN2CN(CCc3ccccc3)c3ccccc32)cc1
InChIInChI=1S/C23H24N2/c1-3-9-20(10-4-1)15-17-24-19-25(23-14-8-7-13-22(23)24)18-16-21-11-5-2-6-12-21/h1-14H,15-19H2
InChIKeyNMNOTNOPXAWHGL-UHFFFAOYSA-N
XLogP4.76
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.46
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,3-bis(2-phenylethyl)-2H-benzimidazole?
The IUPAC name of 1,3-bis(2-phenylethyl)-2H-benzimidazole (CID 510027) is 1,3-bis(2-phenylethyl)-2H-benzimidazole.
What is the SMILES notation for 1,3-bis(2-phenylethyl)-2H-benzimidazole?
The canonical SMILES for 1,3-bis(2-phenylethyl)-2H-benzimidazole is c1ccc(CCN2CN(CCc3ccccc3)c3ccccc32)cc1.
What is the InChIKey of 1,3-bis(2-phenylethyl)-2H-benzimidazole?
The InChIKey is NMNOTNOPXAWHGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2/c1-3-9-20(10-4-1)15-17-24-19-25(23-14-8-7-13-22(23)24)18-16-21-11-5-2-6-12-21/h1-14H,15-19H2.
What are the key properties of 1,3-bis(2-phenylethyl)-2H-benzimidazole?
1,3-bis(2-phenylethyl)-2H-benzimidazole has a molecular weight of 328.46 g/mol, XLogP of 4.76, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis(2-phenylethyl)-2H-benzimidazole is sourced from PubChem (CID 510027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).