4-amino-5-(3-fluoro-4-hydroxyphenyl)-1,5-dihydroimidazol-2-one

C9H8FN3O2 — CID 107693884

IUPAC4-amino-5-(3-fluoro-4-hydroxyphenyl)-1,5-dihydroimidazol-2-one
SMILESNC1=NC(=O)NC1c1ccc(O)c(F)c1
InChIInChI=1S/C9H8FN3O2/c10-5-3-4(1-2-6(5)14)7-8(11)13-9(15)12-7/h1-3,7,14H,(H3,11,12,13,15)
InChIKeyAMOQILCJODRTHA-UHFFFAOYSA-N
MW209.18 g/mol
LogP0.65
Rot. Bonds1

About 4-amino-5-(3-fluoro-4-hydroxyphenyl)-1,5-dihydroimidazol-2-one

4-amino-5-(3-fluoro-4-hydroxyphenyl)-1,5-dihydroimidazol-2-one (PubChem CID 107693884) has the molecular formula C9H8FN3O2 and a molecular weight of 209.18 g/mol. Its IUPAC name is 4-amino-5-(3-fluoro-4-hydroxyphenyl)-1,5-dihydroimidazol-2-one.

Molecular Properties

Compound Name4-amino-5-(3-fluoro-4-hydroxyphenyl)-1,5-dihydroimidazol-2-one
PubChem CID107693884
Molecular FormulaC9H8FN3O2
Molecular Weight209.18 g/mol
Exact Mass209.06
IUPAC Name4-amino-5-(3-fluoro-4-hydroxyphenyl)-1,5-dihydroimidazol-2-one
SMILESNC1=NC(=O)NC1c1ccc(O)c(F)c1
InChIInChI=1S/C9H8FN3O2/c10-5-3-4(1-2-6(5)14)7-8(11)13-9(15)12-7/h1-3,7,14H,(H3,11,12,13,15)
InChIKeyAMOQILCJODRTHA-UHFFFAOYSA-N
XLogP0.65
TPSA87.71 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.18
LogP ≤ 50.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-5-(3-fluoro-4-hydroxyphenyl)-1,5-dihydroimidazol-2-one?
The IUPAC name of 4-amino-5-(3-fluoro-4-hydroxyphenyl)-1,5-dihydroimidazol-2-one (CID 107693884) is 4-amino-5-(3-fluoro-4-hydroxyphenyl)-1,5-dihydroimidazol-2-one.
What is the SMILES notation for 4-amino-5-(3-fluoro-4-hydroxyphenyl)-1,5-dihydroimidazol-2-one?
The canonical SMILES for 4-amino-5-(3-fluoro-4-hydroxyphenyl)-1,5-dihydroimidazol-2-one is NC1=NC(=O)NC1c1ccc(O)c(F)c1.
What is the InChIKey of 4-amino-5-(3-fluoro-4-hydroxyphenyl)-1,5-dihydroimidazol-2-one?
The InChIKey is AMOQILCJODRTHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8FN3O2/c10-5-3-4(1-2-6(5)14)7-8(11)13-9(15)12-7/h1-3,7,14H,(H3,11,12,13,15).
What are the key properties of 4-amino-5-(3-fluoro-4-hydroxyphenyl)-1,5-dihydroimidazol-2-one?
4-amino-5-(3-fluoro-4-hydroxyphenyl)-1,5-dihydroimidazol-2-one has a molecular weight of 209.18 g/mol, XLogP of 0.65, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-(3-fluoro-4-hydroxyphenyl)-1,5-dihydroimidazol-2-one is sourced from PubChem (CID 107693884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).