1-naphthalen-2-yl-2-phenylbenzimidazole

C23H16N2 — CID 134454984

IUPAC1-naphthalen-2-yl-2-phenylbenzimidazole
SMILESc1ccc(-c2nc3ccccc3n2-c2ccc3ccccc3c2)cc1
InChIInChI=1S/C23H16N2/c1-2-9-18(10-3-1)23-24-21-12-6-7-13-22(21)25(23)20-15-14-17-8-4-5-11-19(17)16-20/h1-16H
InChIKeyCPJAIZKTHPKVEU-UHFFFAOYSA-N
MW320.40 g/mol
LogP5.85
Rot. Bonds2

About 1-naphthalen-2-yl-2-phenylbenzimidazole

1-naphthalen-2-yl-2-phenylbenzimidazole (PubChem CID 134454984) has the molecular formula C23H16N2 and a molecular weight of 320.40 g/mol. Its IUPAC name is 1-naphthalen-2-yl-2-phenylbenzimidazole.

Molecular Properties

Compound Name1-naphthalen-2-yl-2-phenylbenzimidazole
PubChem CID134454984
Molecular FormulaC23H16N2
Molecular Weight320.40 g/mol
Exact Mass320.13
IUPAC Name1-naphthalen-2-yl-2-phenylbenzimidazole
SMILESc1ccc(-c2nc3ccccc3n2-c2ccc3ccccc3c2)cc1
InChIInChI=1S/C23H16N2/c1-2-9-18(10-3-1)23-24-21-12-6-7-13-22(21)25(23)20-15-14-17-8-4-5-11-19(17)16-20/h1-16H
InChIKeyCPJAIZKTHPKVEU-UHFFFAOYSA-N
XLogP5.85
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.40
LogP ≤ 55.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-2-yl-2-phenylbenzimidazole?
The IUPAC name of 1-naphthalen-2-yl-2-phenylbenzimidazole (CID 134454984) is 1-naphthalen-2-yl-2-phenylbenzimidazole.
What is the SMILES notation for 1-naphthalen-2-yl-2-phenylbenzimidazole?
The canonical SMILES for 1-naphthalen-2-yl-2-phenylbenzimidazole is c1ccc(-c2nc3ccccc3n2-c2ccc3ccccc3c2)cc1.
What is the InChIKey of 1-naphthalen-2-yl-2-phenylbenzimidazole?
The InChIKey is CPJAIZKTHPKVEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16N2/c1-2-9-18(10-3-1)23-24-21-12-6-7-13-22(21)25(23)20-15-14-17-8-4-5-11-19(17)16-20/h1-16H.
What are the key properties of 1-naphthalen-2-yl-2-phenylbenzimidazole?
1-naphthalen-2-yl-2-phenylbenzimidazole has a molecular weight of 320.40 g/mol, XLogP of 5.85, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-2-yl-2-phenylbenzimidazole is sourced from PubChem (CID 134454984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).