5-amino-4-(3-fluoro-4-hydroxyphenyl)-3-methyl-4H-imidazol-2-one

C10H10FN3O2 — CID 107693887

IUPAC5-amino-4-(3-fluoro-4-hydroxyphenyl)-3-methyl-4H-imidazol-2-one
SMILESCN1C(=O)N=C(N)C1c1ccc(O)c(F)c1
InChIInChI=1S/C10H10FN3O2/c1-14-8(9(12)13-10(14)16)5-2-3-7(15)6(11)4-5/h2-4,8,15H,1H3,(H2,12,13,16)
InChIKeyGGFUOSNYHMIQGW-UHFFFAOYSA-N
MW223.21 g/mol
LogP1.00
Rot. Bonds1

About 5-amino-4-(3-fluoro-4-hydroxyphenyl)-3-methyl-4H-imidazol-2-one

5-amino-4-(3-fluoro-4-hydroxyphenyl)-3-methyl-4H-imidazol-2-one (PubChem CID 107693887) has the molecular formula C10H10FN3O2 and a molecular weight of 223.21 g/mol. Its IUPAC name is 5-amino-4-(3-fluoro-4-hydroxyphenyl)-3-methyl-4H-imidazol-2-one.

Molecular Properties

Compound Name5-amino-4-(3-fluoro-4-hydroxyphenyl)-3-methyl-4H-imidazol-2-one
PubChem CID107693887
Molecular FormulaC10H10FN3O2
Molecular Weight223.21 g/mol
Exact Mass223.08
IUPAC Name5-amino-4-(3-fluoro-4-hydroxyphenyl)-3-methyl-4H-imidazol-2-one
SMILESCN1C(=O)N=C(N)C1c1ccc(O)c(F)c1
InChIInChI=1S/C10H10FN3O2/c1-14-8(9(12)13-10(14)16)5-2-3-7(15)6(11)4-5/h2-4,8,15H,1H3,(H2,12,13,16)
InChIKeyGGFUOSNYHMIQGW-UHFFFAOYSA-N
XLogP1.00
TPSA78.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.21
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-amino-4-(3-fluoro-4-hydroxyphenyl)-3-methyl-4H-imidazol-2-one?
The IUPAC name of 5-amino-4-(3-fluoro-4-hydroxyphenyl)-3-methyl-4H-imidazol-2-one (CID 107693887) is 5-amino-4-(3-fluoro-4-hydroxyphenyl)-3-methyl-4H-imidazol-2-one.
What is the SMILES notation for 5-amino-4-(3-fluoro-4-hydroxyphenyl)-3-methyl-4H-imidazol-2-one?
The canonical SMILES for 5-amino-4-(3-fluoro-4-hydroxyphenyl)-3-methyl-4H-imidazol-2-one is CN1C(=O)N=C(N)C1c1ccc(O)c(F)c1.
What is the InChIKey of 5-amino-4-(3-fluoro-4-hydroxyphenyl)-3-methyl-4H-imidazol-2-one?
The InChIKey is GGFUOSNYHMIQGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN3O2/c1-14-8(9(12)13-10(14)16)5-2-3-7(15)6(11)4-5/h2-4,8,15H,1H3,(H2,12,13,16).
What are the key properties of 5-amino-4-(3-fluoro-4-hydroxyphenyl)-3-methyl-4H-imidazol-2-one?
5-amino-4-(3-fluoro-4-hydroxyphenyl)-3-methyl-4H-imidazol-2-one has a molecular weight of 223.21 g/mol, XLogP of 1.00, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-4-(3-fluoro-4-hydroxyphenyl)-3-methyl-4H-imidazol-2-one is sourced from PubChem (CID 107693887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).