5-(2-fluoro-5-pyridin-3-ylphenyl)-3-methyl-5-phenyl-4H-imidazol-2-amine

C21H19FN4 — CID 69301033

IUPAC5-(2-fluoro-5-pyridin-3-ylphenyl)-3-methyl-5-phenyl-4H-imidazol-2-amine
SMILESCN1CC(c2ccccc2)(c2cc(-c3cccnc3)ccc2F)N=C1N
InChIInChI=1S/C21H19FN4/c1-26-14-21(25-20(26)23,17-7-3-2-4-8-17)18-12-15(9-10-19(18)22)16-6-5-11-24-13-16/h2-13H,14H2,1H3,(H2,23,25)
InChIKeyZZFSRCQTPAGIOR-UHFFFAOYSA-N
MW346.41 g/mol
LogP3.39
Rot. Bonds3

About 5-(2-fluoro-5-pyridin-3-ylphenyl)-3-methyl-5-phenyl-4H-imidazol-2-amine

5-(2-fluoro-5-pyridin-3-ylphenyl)-3-methyl-5-phenyl-4H-imidazol-2-amine (PubChem CID 69301033) has the molecular formula C21H19FN4 and a molecular weight of 346.41 g/mol. Its IUPAC name is 5-(2-fluoro-5-pyridin-3-ylphenyl)-3-methyl-5-phenyl-4H-imidazol-2-amine.

Molecular Properties

Compound Name5-(2-fluoro-5-pyridin-3-ylphenyl)-3-methyl-5-phenyl-4H-imidazol-2-amine
PubChem CID69301033
Molecular FormulaC21H19FN4
Molecular Weight346.41 g/mol
Exact Mass346.16
IUPAC Name5-(2-fluoro-5-pyridin-3-ylphenyl)-3-methyl-5-phenyl-4H-imidazol-2-amine
SMILESCN1CC(c2ccccc2)(c2cc(-c3cccnc3)ccc2F)N=C1N
InChIInChI=1S/C21H19FN4/c1-26-14-21(25-20(26)23,17-7-3-2-4-8-17)18-12-15(9-10-19(18)22)16-6-5-11-24-13-16/h2-13H,14H2,1H3,(H2,23,25)
InChIKeyZZFSRCQTPAGIOR-UHFFFAOYSA-N
XLogP3.39
TPSA54.51 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.41
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(2-fluoro-5-pyridin-3-ylphenyl)-3-methyl-5-phenyl-4H-imidazol-2-amine?
The IUPAC name of 5-(2-fluoro-5-pyridin-3-ylphenyl)-3-methyl-5-phenyl-4H-imidazol-2-amine (CID 69301033) is 5-(2-fluoro-5-pyridin-3-ylphenyl)-3-methyl-5-phenyl-4H-imidazol-2-amine.
What is the SMILES notation for 5-(2-fluoro-5-pyridin-3-ylphenyl)-3-methyl-5-phenyl-4H-imidazol-2-amine?
The canonical SMILES for 5-(2-fluoro-5-pyridin-3-ylphenyl)-3-methyl-5-phenyl-4H-imidazol-2-amine is CN1CC(c2ccccc2)(c2cc(-c3cccnc3)ccc2F)N=C1N.
What is the InChIKey of 5-(2-fluoro-5-pyridin-3-ylphenyl)-3-methyl-5-phenyl-4H-imidazol-2-amine?
The InChIKey is ZZFSRCQTPAGIOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19FN4/c1-26-14-21(25-20(26)23,17-7-3-2-4-8-17)18-12-15(9-10-19(18)22)16-6-5-11-24-13-16/h2-13H,14H2,1H3,(H2,23,25).
What are the key properties of 5-(2-fluoro-5-pyridin-3-ylphenyl)-3-methyl-5-phenyl-4H-imidazol-2-amine?
5-(2-fluoro-5-pyridin-3-ylphenyl)-3-methyl-5-phenyl-4H-imidazol-2-amine has a molecular weight of 346.41 g/mol, XLogP of 3.39, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-fluoro-5-pyridin-3-ylphenyl)-3-methyl-5-phenyl-4H-imidazol-2-amine is sourced from PubChem (CID 69301033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).