2-phenyl-1H-benzo[f]benzimidazole

C17H12N2 — CID 13074514

IUPAC2-phenyl-1H-benzo[f]benzimidazole
SMILESc1ccc(-c2nc3cc4ccccc4cc3[nH]2)cc1
InChIInChI=1S/C17H12N2/c1-2-6-12(7-3-1)17-18-15-10-13-8-4-5-9-14(13)11-16(15)19-17/h1-11H,(H,18,19)
InChIKeyHCPGKWFSUQLZEP-UHFFFAOYSA-N
MW244.30 g/mol
LogP4.38
Rot. Bonds1

About 2-phenyl-1H-benzo[f]benzimidazole

2-phenyl-1H-benzo[f]benzimidazole (PubChem CID 13074514) has the molecular formula C17H12N2 and a molecular weight of 244.30 g/mol. Its IUPAC name is 2-phenyl-1H-benzo[f]benzimidazole.

Molecular Properties

Compound Name2-phenyl-1H-benzo[f]benzimidazole
PubChem CID13074514
Molecular FormulaC17H12N2
Molecular Weight244.30 g/mol
Exact Mass244.10
IUPAC Name2-phenyl-1H-benzo[f]benzimidazole
SMILESc1ccc(-c2nc3cc4ccccc4cc3[nH]2)cc1
InChIInChI=1S/C17H12N2/c1-2-6-12(7-3-1)17-18-15-10-13-8-4-5-9-14(13)11-16(15)19-17/h1-11H,(H,18,19)
InChIKeyHCPGKWFSUQLZEP-UHFFFAOYSA-N
XLogP4.38
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-pyridin-3-yl-1H-benzo[f]benzimidazole
CID 3152015
2-phenyl-3H-benzimidazole-5-thiol
CID 57216404
5-bromo-6-fluoro-2-phenyl-1H-benzimidazole
CID 79631220
azane;2-phenyl-1H-benzimidazole
CID 172858780
2-phenyl-1H-benzimidazole;hydrobromide
CID 160835464
2-phenyl-1H-benzimidazole;zinc
CID 174639851
2-phenyl-1H-benzimidazole;zirconium(4+);tetrachloride
CID 173061121
bis(2-phenyl-3H-benzimidazol-5-yl)methanone
CID 174583837
2-phenyl-6-[(2-phenyl-3H-benzimidazol-5-yl)sulfonyl]-1H-benzimidazole
CID 101498548
N,N-dihydroxy-2-phenyl-3H-benzimidazol-5-amine
CID 123138623
2-[(2-phenyl-3H-benzimidazol-5-yl)oxy]ethanol
CID 84816371
1H-benzo[f]benzimidazole-2-carbonitrile
CID 45078096

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-1H-benzo[f]benzimidazole?
The IUPAC name of 2-phenyl-1H-benzo[f]benzimidazole (CID 13074514) is 2-phenyl-1H-benzo[f]benzimidazole.
What is the SMILES notation for 2-phenyl-1H-benzo[f]benzimidazole?
The canonical SMILES for 2-phenyl-1H-benzo[f]benzimidazole is c1ccc(-c2nc3cc4ccccc4cc3[nH]2)cc1.
What is the InChIKey of 2-phenyl-1H-benzo[f]benzimidazole?
The InChIKey is HCPGKWFSUQLZEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N2/c1-2-6-12(7-3-1)17-18-15-10-13-8-4-5-9-14(13)11-16(15)19-17/h1-11H,(H,18,19).
What are the key properties of 2-phenyl-1H-benzo[f]benzimidazole?
2-phenyl-1H-benzo[f]benzimidazole has a molecular weight of 244.30 g/mol, XLogP of 4.38, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-1H-benzo[f]benzimidazole is sourced from PubChem (CID 13074514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).