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

C10H10FN3O — CID 82997241

IUPAC2-amino-4-(4-fluoro-3-methylphenyl)-1,4-dihydroimidazol-5-one
SMILESCc1cc(C2N=C(N)NC2=O)ccc1F
InChIInChI=1S/C10H10FN3O/c1-5-4-6(2-3-7(5)11)8-9(15)14-10(12)13-8/h2-4,8H,1H3,(H3,12,13,14,15)
InChIKeyLKNLNAFNPWUELB-UHFFFAOYSA-N
MW207.21 g/mol
LogP0.62
Rot. Bonds1

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

2-amino-4-(4-fluoro-3-methylphenyl)-1,4-dihydroimidazol-5-one (PubChem CID 82997241) has the molecular formula C10H10FN3O and a molecular weight of 207.21 g/mol. Its IUPAC name is 2-amino-4-(4-fluoro-3-methylphenyl)-1,4-dihydroimidazol-5-one.

Molecular Properties

Compound Name2-amino-4-(4-fluoro-3-methylphenyl)-1,4-dihydroimidazol-5-one
PubChem CID82997241
Molecular FormulaC10H10FN3O
Molecular Weight207.21 g/mol
Exact Mass207.08
IUPAC Name2-amino-4-(4-fluoro-3-methylphenyl)-1,4-dihydroimidazol-5-one
SMILESCc1cc(C2N=C(N)NC2=O)ccc1F
InChIInChI=1S/C10H10FN3O/c1-5-4-6(2-3-7(5)11)8-9(15)14-10(12)13-8/h2-4,8H,1H3,(H3,12,13,14,15)
InChIKeyLKNLNAFNPWUELB-UHFFFAOYSA-N
XLogP0.62
TPSA67.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.21
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-4-(4-fluoro-3-methylphenyl)-1,4-dihydroimidazol-5-one?
The IUPAC name of 2-amino-4-(4-fluoro-3-methylphenyl)-1,4-dihydroimidazol-5-one (CID 82997241) is 2-amino-4-(4-fluoro-3-methylphenyl)-1,4-dihydroimidazol-5-one.
What is the SMILES notation for 2-amino-4-(4-fluoro-3-methylphenyl)-1,4-dihydroimidazol-5-one?
The canonical SMILES for 2-amino-4-(4-fluoro-3-methylphenyl)-1,4-dihydroimidazol-5-one is Cc1cc(C2N=C(N)NC2=O)ccc1F.
What is the InChIKey of 2-amino-4-(4-fluoro-3-methylphenyl)-1,4-dihydroimidazol-5-one?
The InChIKey is LKNLNAFNPWUELB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN3O/c1-5-4-6(2-3-7(5)11)8-9(15)14-10(12)13-8/h2-4,8H,1H3,(H3,12,13,14,15).
What are the key properties of 2-amino-4-(4-fluoro-3-methylphenyl)-1,4-dihydroimidazol-5-one?
2-amino-4-(4-fluoro-3-methylphenyl)-1,4-dihydroimidazol-5-one has a molecular weight of 207.21 g/mol, XLogP of 0.62, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-(4-fluoro-3-methylphenyl)-1,4-dihydroimidazol-5-one is sourced from PubChem (CID 82997241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).