2-(2,3-dihydro-1H-indol-5-yl)-6-fluoro-1H-benzimidazole

C15H12FN3 — CID 60785781

IUPAC2-(2,3-dihydro-1H-indol-5-yl)-6-fluoro-1H-benzimidazole
SMILESFc1ccc2nc(-c3ccc4c(c3)CCN4)[nH]c2c1
InChIInChI=1S/C15H12FN3/c16-11-2-4-13-14(8-11)19-15(18-13)10-1-3-12-9(7-10)5-6-17-12/h1-4,7-8,17H,5-6H2,(H,18,19)
InChIKeyWIURLBWZGISBKW-UHFFFAOYSA-N
MW253.28 g/mol
LogP3.34
Rot. Bonds1

About 2-(2,3-dihydro-1H-indol-5-yl)-6-fluoro-1H-benzimidazole

2-(2,3-dihydro-1H-indol-5-yl)-6-fluoro-1H-benzimidazole (PubChem CID 60785781) has the molecular formula C15H12FN3 and a molecular weight of 253.28 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-indol-5-yl)-6-fluoro-1H-benzimidazole.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-indol-5-yl)-6-fluoro-1H-benzimidazole
PubChem CID60785781
Molecular FormulaC15H12FN3
Molecular Weight253.28 g/mol
Exact Mass253.10
IUPAC Name2-(2,3-dihydro-1H-indol-5-yl)-6-fluoro-1H-benzimidazole
SMILESFc1ccc2nc(-c3ccc4c(c3)CCN4)[nH]c2c1
InChIInChI=1S/C15H12FN3/c16-11-2-4-13-14(8-11)19-15(18-13)10-1-3-12-9(7-10)5-6-17-12/h1-4,7-8,17H,5-6H2,(H,18,19)
InChIKeyWIURLBWZGISBKW-UHFFFAOYSA-N
XLogP3.34
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.28
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1,2,3,4-tetrahydroquinolin-6-yl)-3H-benzimidazol-5-ol
CID 81429590
6-(5,6-dichloro-1H-benzimidazol-2-yl)-1,2,3,4-tetrahydroquinoline
CID 82005414
6-(4,6-difluoro-1H-benzimidazol-2-yl)-1,2,3,4-tetrahydroquinoline
CID 81448401
4-(6-fluoro-1H-benzimidazol-2-yl)aniline
CID 22387237
2-(4-chloro-3-fluorophenyl)-6-fluoro-1H-benzimidazole
CID 113227780
6-fluoro-2-(2-methyl-4-pyridinyl)-1H-benzimidazole
CID 106753306
6-fluoro-2-(4-methylsulfanylphenyl)-1H-benzimidazole
CID 112730258
5-(6-fluoro-1H-benzimidazol-2-yl)-2-methylaniline
CID 54919597
2-bromo-4-(6-fluoro-1H-benzimidazol-2-yl)phenol
CID 136837301
6-(4,5-difluoro-1H-benzimidazol-2-yl)-1,2,3,4-tetrahydroquinoline
CID 115911844
6-fluoro-2-pyrimidin-5-yl-1H-benzimidazole
CID 102922110
6-fluoro-2-(1-methylpyrazol-4-yl)-1H-benzimidazole
CID 60980673

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-indol-5-yl)-6-fluoro-1H-benzimidazole?
The IUPAC name of 2-(2,3-dihydro-1H-indol-5-yl)-6-fluoro-1H-benzimidazole (CID 60785781) is 2-(2,3-dihydro-1H-indol-5-yl)-6-fluoro-1H-benzimidazole.
What is the SMILES notation for 2-(2,3-dihydro-1H-indol-5-yl)-6-fluoro-1H-benzimidazole?
The canonical SMILES for 2-(2,3-dihydro-1H-indol-5-yl)-6-fluoro-1H-benzimidazole is Fc1ccc2nc(-c3ccc4c(c3)CCN4)[nH]c2c1.
What is the InChIKey of 2-(2,3-dihydro-1H-indol-5-yl)-6-fluoro-1H-benzimidazole?
The InChIKey is WIURLBWZGISBKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FN3/c16-11-2-4-13-14(8-11)19-15(18-13)10-1-3-12-9(7-10)5-6-17-12/h1-4,7-8,17H,5-6H2,(H,18,19).
What are the key properties of 2-(2,3-dihydro-1H-indol-5-yl)-6-fluoro-1H-benzimidazole?
2-(2,3-dihydro-1H-indol-5-yl)-6-fluoro-1H-benzimidazole has a molecular weight of 253.28 g/mol, XLogP of 3.34, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-indol-5-yl)-6-fluoro-1H-benzimidazole is sourced from PubChem (CID 60785781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).