N-(5-fluoro-2-methylphenyl)-5-methyl-1H-imidazol-2-amine

C11H12FN3 — CID 106559294

IUPACN-(5-fluoro-2-methylphenyl)-5-methyl-1H-imidazol-2-amine
SMILESCc1cnc(Nc2cc(F)ccc2C)[nH]1
InChIInChI=1S/C11H12FN3/c1-7-3-4-9(12)5-10(7)15-11-13-6-8(2)14-11/h3-6H,1-2H3,(H2,13,14,15)
InChIKeyZPKPOWSVOMENHX-UHFFFAOYSA-N
MW205.24 g/mol
LogP2.91
Rot. Bonds2

About N-(5-fluoro-2-methylphenyl)-5-methyl-1H-imidazol-2-amine

N-(5-fluoro-2-methylphenyl)-5-methyl-1H-imidazol-2-amine (PubChem CID 106559294) has the molecular formula C11H12FN3 and a molecular weight of 205.24 g/mol. Its IUPAC name is N-(5-fluoro-2-methylphenyl)-5-methyl-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-(5-fluoro-2-methylphenyl)-5-methyl-1H-imidazol-2-amine
PubChem CID106559294
Molecular FormulaC11H12FN3
Molecular Weight205.24 g/mol
Exact Mass205.10
IUPAC NameN-(5-fluoro-2-methylphenyl)-5-methyl-1H-imidazol-2-amine
SMILESCc1cnc(Nc2cc(F)ccc2C)[nH]1
InChIInChI=1S/C11H12FN3/c1-7-3-4-9(12)5-10(7)15-11-13-6-8(2)14-11/h3-6H,1-2H3,(H2,13,14,15)
InChIKeyZPKPOWSVOMENHX-UHFFFAOYSA-N
XLogP2.91
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.24
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2-methylphenyl)-5-methyl-1H-imidazol-2-amine?
The IUPAC name of N-(5-fluoro-2-methylphenyl)-5-methyl-1H-imidazol-2-amine (CID 106559294) is N-(5-fluoro-2-methylphenyl)-5-methyl-1H-imidazol-2-amine.
What is the SMILES notation for N-(5-fluoro-2-methylphenyl)-5-methyl-1H-imidazol-2-amine?
The canonical SMILES for N-(5-fluoro-2-methylphenyl)-5-methyl-1H-imidazol-2-amine is Cc1cnc(Nc2cc(F)ccc2C)[nH]1.
What is the InChIKey of N-(5-fluoro-2-methylphenyl)-5-methyl-1H-imidazol-2-amine?
The InChIKey is ZPKPOWSVOMENHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FN3/c1-7-3-4-9(12)5-10(7)15-11-13-6-8(2)14-11/h3-6H,1-2H3,(H2,13,14,15).
What are the key properties of N-(5-fluoro-2-methylphenyl)-5-methyl-1H-imidazol-2-amine?
N-(5-fluoro-2-methylphenyl)-5-methyl-1H-imidazol-2-amine has a molecular weight of 205.24 g/mol, XLogP of 2.91, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2-methylphenyl)-5-methyl-1H-imidazol-2-amine is sourced from PubChem (CID 106559294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).