2-[2-(4-fluorophenyl)-4H-imidazo[1,2-a]benzimidazol-1-yl]ethanamine

C17H15FN4 — CID 142766555

IUPAC2-[2-(4-fluorophenyl)-4H-imidazo[1,2-a]benzimidazol-1-yl]ethanamine
SMILESNCCc1c(-c2ccc(F)cc2)nc2[nH]c3ccccc3n12
InChIInChI=1S/C17H15FN4/c18-12-7-5-11(6-8-12)16-15(9-10-19)22-14-4-2-1-3-13(14)20-17(22)21-16/h1-8H,9-10,19H2,(H,20,21)
InChIKeyKANGHWAQXBNIJH-UHFFFAOYSA-N
MW294.33 g/mol
LogP3.12
Rot. Bonds3

About 2-[2-(4-fluorophenyl)-4H-imidazo[1,2-a]benzimidazol-1-yl]ethanamine

2-[2-(4-fluorophenyl)-4H-imidazo[1,2-a]benzimidazol-1-yl]ethanamine (PubChem CID 142766555) has the molecular formula C17H15FN4 and a molecular weight of 294.33 g/mol. Its IUPAC name is 2-[2-(4-fluorophenyl)-4H-imidazo[1,2-a]benzimidazol-1-yl]ethanamine.

Molecular Properties

Compound Name2-[2-(4-fluorophenyl)-4H-imidazo[1,2-a]benzimidazol-1-yl]ethanamine
PubChem CID142766555
Molecular FormulaC17H15FN4
Molecular Weight294.33 g/mol
Exact Mass294.13
IUPAC Name2-[2-(4-fluorophenyl)-4H-imidazo[1,2-a]benzimidazol-1-yl]ethanamine
SMILESNCCc1c(-c2ccc(F)cc2)nc2[nH]c3ccccc3n12
InChIInChI=1S/C17H15FN4/c18-12-7-5-11(6-8-12)16-15(9-10-19)22-14-4-2-1-3-13(14)20-17(22)21-16/h1-8H,9-10,19H2,(H,20,21)
InChIKeyKANGHWAQXBNIJH-UHFFFAOYSA-N
XLogP3.12
TPSA59.11 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.33
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[6-(4-fluorophenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
CID 39194944
1-nitroso-2-phenyl-4H-imidazo[1,2-a]benzimidazole
CID 671760
2-[2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-yl]ethanamine
CID 82299531
3-(2-aminoethyl)-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-8-ol
CID 82055555
2-[4-(4-fluorophenyl)-2-methyl-1H-imidazol-5-yl]ethanamine
CID 82285806
3-[2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-yl]propan-1-amine
CID 170879132
2-[3-(4-fluorophenyl)-6-propan-2-ylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
CID 82062511
[1-(4-fluorophenyl)-9H-pyrido[3,4-b]indol-3-yl]methanamine
CID 122185830
5-(2-fluoroethyl)-2-(4-fluorophenyl)-4-phenyl-1H-imidazole
CID 13470703
2-(4-phenyl-2-propan-2-yl-1H-imidazol-5-yl)ethanamine
CID 82288554
2,3,5,6-tetrakis(4-fluorophenyl)pyrazine
CID 132966321
2-[6-fluoro-2-(4-fluoro-3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]ethanamine
CID 82530532

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-fluorophenyl)-4H-imidazo[1,2-a]benzimidazol-1-yl]ethanamine?
The IUPAC name of 2-[2-(4-fluorophenyl)-4H-imidazo[1,2-a]benzimidazol-1-yl]ethanamine (CID 142766555) is 2-[2-(4-fluorophenyl)-4H-imidazo[1,2-a]benzimidazol-1-yl]ethanamine.
What is the SMILES notation for 2-[2-(4-fluorophenyl)-4H-imidazo[1,2-a]benzimidazol-1-yl]ethanamine?
The canonical SMILES for 2-[2-(4-fluorophenyl)-4H-imidazo[1,2-a]benzimidazol-1-yl]ethanamine is NCCc1c(-c2ccc(F)cc2)nc2[nH]c3ccccc3n12.
What is the InChIKey of 2-[2-(4-fluorophenyl)-4H-imidazo[1,2-a]benzimidazol-1-yl]ethanamine?
The InChIKey is KANGHWAQXBNIJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN4/c18-12-7-5-11(6-8-12)16-15(9-10-19)22-14-4-2-1-3-13(14)20-17(22)21-16/h1-8H,9-10,19H2,(H,20,21).
What are the key properties of 2-[2-(4-fluorophenyl)-4H-imidazo[1,2-a]benzimidazol-1-yl]ethanamine?
2-[2-(4-fluorophenyl)-4H-imidazo[1,2-a]benzimidazol-1-yl]ethanamine has a molecular weight of 294.33 g/mol, XLogP of 3.12, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-fluorophenyl)-4H-imidazo[1,2-a]benzimidazol-1-yl]ethanamine is sourced from PubChem (CID 142766555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).