5-(4-ethoxy-3-fluorophenyl)-1H-imidazol-2-amine

C11H12FN3O — CID 82286480

IUPAC5-(4-ethoxy-3-fluorophenyl)-1H-imidazol-2-amine
SMILESCCOc1ccc(-c2cnc(N)[nH]2)cc1F
InChIInChI=1S/C11H12FN3O/c1-2-16-10-4-3-7(5-8(10)12)9-6-14-11(13)15-9/h3-6H,2H2,1H3,(H3,13,14,15)
InChIKeyJPJJIMYUEQSDAO-UHFFFAOYSA-N
MW221.23 g/mol
LogP2.20
Rot. Bonds3

About 5-(4-ethoxy-3-fluorophenyl)-1H-imidazol-2-amine

5-(4-ethoxy-3-fluorophenyl)-1H-imidazol-2-amine (PubChem CID 82286480) has the molecular formula C11H12FN3O and a molecular weight of 221.23 g/mol. Its IUPAC name is 5-(4-ethoxy-3-fluorophenyl)-1H-imidazol-2-amine.

Molecular Properties

Compound Name5-(4-ethoxy-3-fluorophenyl)-1H-imidazol-2-amine
PubChem CID82286480
Molecular FormulaC11H12FN3O
Molecular Weight221.23 g/mol
Exact Mass221.10
IUPAC Name5-(4-ethoxy-3-fluorophenyl)-1H-imidazol-2-amine
SMILESCCOc1ccc(-c2cnc(N)[nH]2)cc1F
InChIInChI=1S/C11H12FN3O/c1-2-16-10-4-3-7(5-8(10)12)9-6-14-11(13)15-9/h3-6H,2H2,1H3,(H3,13,14,15)
InChIKeyJPJJIMYUEQSDAO-UHFFFAOYSA-N
XLogP2.20
TPSA63.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.23
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(3-fluoro-4-propan-2-yloxyphenyl)-1H-imidazol-2-amine
CID 82291079
2-[5-(4-ethoxy-3-fluorophenyl)-1H-imidazol-2-yl]-N-methylethanamine
CID 95469456
6-(4-ethoxy-3-fluorophenyl)-1H-pyridin-2-one
CID 122358370
2-bromo-5-(4-ethoxy-3-methylphenyl)-1H-imidazole
CID 116884267
4-(4-ethoxy-3-fluorophenyl)-5-(2-methyl-4-pyridinyl)-1H-imidazol-2-amine
CID 142578077
2-[5-(3-fluoro-4-methoxyphenyl)-1H-imidazol-2-yl]propan-1-amine
CID 65233281
5-phenyl-1H-imidazol-2-amine;propane
CID 143872640
3-amino-4-(4-ethoxy-3-fluorophenyl)-1H-pyrazole-5-carboxylic acid
CID 82486573
6-[5-(3-fluoro-4-methoxyphenyl)-1H-imidazol-2-yl]hexan-1-amine
CID 43651738
4-(4-ethoxy-3-fluorophenyl)-5-ethyl-1,3-oxazol-2-amine
CID 116831911
5-(3-chloro-4-ethoxyphenyl)-2-methoxy-1H-imidazole
CID 116883702
5-(4-methylsulfanylphenyl)-1H-imidazol-2-amine
CID 66202105

Frequently Asked Questions

What is the IUPAC name of 5-(4-ethoxy-3-fluorophenyl)-1H-imidazol-2-amine?
The IUPAC name of 5-(4-ethoxy-3-fluorophenyl)-1H-imidazol-2-amine (CID 82286480) is 5-(4-ethoxy-3-fluorophenyl)-1H-imidazol-2-amine.
What is the SMILES notation for 5-(4-ethoxy-3-fluorophenyl)-1H-imidazol-2-amine?
The canonical SMILES for 5-(4-ethoxy-3-fluorophenyl)-1H-imidazol-2-amine is CCOc1ccc(-c2cnc(N)[nH]2)cc1F.
What is the InChIKey of 5-(4-ethoxy-3-fluorophenyl)-1H-imidazol-2-amine?
The InChIKey is JPJJIMYUEQSDAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FN3O/c1-2-16-10-4-3-7(5-8(10)12)9-6-14-11(13)15-9/h3-6H,2H2,1H3,(H3,13,14,15).
What are the key properties of 5-(4-ethoxy-3-fluorophenyl)-1H-imidazol-2-amine?
5-(4-ethoxy-3-fluorophenyl)-1H-imidazol-2-amine has a molecular weight of 221.23 g/mol, XLogP of 2.20, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethoxy-3-fluorophenyl)-1H-imidazol-2-amine is sourced from PubChem (CID 82286480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).