5-(3-fluoro-4-propan-2-yloxyphenyl)-1H-imidazol-2-amine

C12H14FN3O — CID 82291079

IUPAC5-(3-fluoro-4-propan-2-yloxyphenyl)-1H-imidazol-2-amine
SMILESCC(C)Oc1ccc(-c2cnc(N)[nH]2)cc1F
InChIInChI=1S/C12H14FN3O/c1-7(2)17-11-4-3-8(5-9(11)13)10-6-15-12(14)16-10/h3-7H,1-2H3,(H3,14,15,16)
InChIKeySAHYILFDRRGWOM-UHFFFAOYSA-N
MW235.26 g/mol
LogP2.59
Rot. Bonds3

About 5-(3-fluoro-4-propan-2-yloxyphenyl)-1H-imidazol-2-amine

5-(3-fluoro-4-propan-2-yloxyphenyl)-1H-imidazol-2-amine (PubChem CID 82291079) has the molecular formula C12H14FN3O and a molecular weight of 235.26 g/mol. Its IUPAC name is 5-(3-fluoro-4-propan-2-yloxyphenyl)-1H-imidazol-2-amine.

Molecular Properties

Compound Name5-(3-fluoro-4-propan-2-yloxyphenyl)-1H-imidazol-2-amine
PubChem CID82291079
Molecular FormulaC12H14FN3O
Molecular Weight235.26 g/mol
Exact Mass235.11
IUPAC Name5-(3-fluoro-4-propan-2-yloxyphenyl)-1H-imidazol-2-amine
SMILESCC(C)Oc1ccc(-c2cnc(N)[nH]2)cc1F
InChIInChI=1S/C12H14FN3O/c1-7(2)17-11-4-3-8(5-9(11)13)10-6-15-12(14)16-10/h3-7H,1-2H3,(H3,14,15,16)
InChIKeySAHYILFDRRGWOM-UHFFFAOYSA-N
XLogP2.59
TPSA63.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.26
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-ethoxy-3-fluorophenyl)-1H-imidazol-2-amine
CID 82286480
3-(3-fluoro-4-propan-2-yloxyphenyl)-1,2-oxazol-5-amine
CID 82476360
2-[5-(3-fluoro-4-methoxyphenyl)-1H-imidazol-2-yl]propan-1-amine
CID 65233281
8-(3-fluoro-4-propan-2-yloxyphenyl)-7H-purine
CID 167832358
4-(3-fluoro-4-propan-2-yloxyphenyl)-1,3-thiazole-2,5-diamine
CID 82487308
[3-(3-fluoro-4-propan-2-yloxyphenyl)pyrazin-2-yl]methanamine
CID 82485077
6-[5-(3-fluoro-4-methoxyphenyl)-1H-imidazol-2-yl]hexan-1-amine
CID 43651738
cyclohexyl-[5-(3-fluoro-4-methoxyphenyl)-1H-imidazol-2-yl]methanamine
CID 67214797
5-(4-methylsulfanylphenyl)-1H-imidazol-2-amine
CID 66202105
3-amino-5-(3-fluoro-4-propan-2-yloxyphenyl)-1H-pyrazole-4-carboxylic acid
CID 98022153
2-[5-(4-ethoxy-3-fluorophenyl)-1H-imidazol-2-yl]-N-methylethanamine
CID 95469456
5-(2-methyl-4-pyridinyl)-1H-imidazol-2-amine
CID 20561075

Frequently Asked Questions

What is the IUPAC name of 5-(3-fluoro-4-propan-2-yloxyphenyl)-1H-imidazol-2-amine?
The IUPAC name of 5-(3-fluoro-4-propan-2-yloxyphenyl)-1H-imidazol-2-amine (CID 82291079) is 5-(3-fluoro-4-propan-2-yloxyphenyl)-1H-imidazol-2-amine.
What is the SMILES notation for 5-(3-fluoro-4-propan-2-yloxyphenyl)-1H-imidazol-2-amine?
The canonical SMILES for 5-(3-fluoro-4-propan-2-yloxyphenyl)-1H-imidazol-2-amine is CC(C)Oc1ccc(-c2cnc(N)[nH]2)cc1F.
What is the InChIKey of 5-(3-fluoro-4-propan-2-yloxyphenyl)-1H-imidazol-2-amine?
The InChIKey is SAHYILFDRRGWOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FN3O/c1-7(2)17-11-4-3-8(5-9(11)13)10-6-15-12(14)16-10/h3-7H,1-2H3,(H3,14,15,16).
What are the key properties of 5-(3-fluoro-4-propan-2-yloxyphenyl)-1H-imidazol-2-amine?
5-(3-fluoro-4-propan-2-yloxyphenyl)-1H-imidazol-2-amine has a molecular weight of 235.26 g/mol, XLogP of 2.59, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-fluoro-4-propan-2-yloxyphenyl)-1H-imidazol-2-amine is sourced from PubChem (CID 82291079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).