1-(2-fluoro-4-methylphenyl)-4-methylimidazol-2-amine

C11H12FN3 — CID 106560440

IUPAC1-(2-fluoro-4-methylphenyl)-4-methylimidazol-2-amine
SMILESCc1ccc(-n2cc(C)nc2N)c(F)c1
InChIInChI=1S/C11H12FN3/c1-7-3-4-10(9(12)5-7)15-6-8(2)14-11(15)13/h3-6H,1-2H3,(H2,13,14)
InChIKeyWIQKTSXGHFHPMT-UHFFFAOYSA-N
MW205.24 g/mol
LogP2.21
Rot. Bonds1

About 1-(2-fluoro-4-methylphenyl)-4-methylimidazol-2-amine

1-(2-fluoro-4-methylphenyl)-4-methylimidazol-2-amine (PubChem CID 106560440) has the molecular formula C11H12FN3 and a molecular weight of 205.24 g/mol. Its IUPAC name is 1-(2-fluoro-4-methylphenyl)-4-methylimidazol-2-amine.

Molecular Properties

Compound Name1-(2-fluoro-4-methylphenyl)-4-methylimidazol-2-amine
PubChem CID106560440
Molecular FormulaC11H12FN3
Molecular Weight205.24 g/mol
Exact Mass205.10
IUPAC Name1-(2-fluoro-4-methylphenyl)-4-methylimidazol-2-amine
SMILESCc1ccc(-n2cc(C)nc2N)c(F)c1
InChIInChI=1S/C11H12FN3/c1-7-3-4-10(9(12)5-7)15-6-8(2)14-11(15)13/h3-6H,1-2H3,(H2,13,14)
InChIKeyWIQKTSXGHFHPMT-UHFFFAOYSA-N
XLogP2.21
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.24
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoro-4-methylphenyl)-4-methylimidazol-2-amine?
The IUPAC name of 1-(2-fluoro-4-methylphenyl)-4-methylimidazol-2-amine (CID 106560440) is 1-(2-fluoro-4-methylphenyl)-4-methylimidazol-2-amine.
What is the SMILES notation for 1-(2-fluoro-4-methylphenyl)-4-methylimidazol-2-amine?
The canonical SMILES for 1-(2-fluoro-4-methylphenyl)-4-methylimidazol-2-amine is Cc1ccc(-n2cc(C)nc2N)c(F)c1.
What is the InChIKey of 1-(2-fluoro-4-methylphenyl)-4-methylimidazol-2-amine?
The InChIKey is WIQKTSXGHFHPMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FN3/c1-7-3-4-10(9(12)5-7)15-6-8(2)14-11(15)13/h3-6H,1-2H3,(H2,13,14).
What are the key properties of 1-(2-fluoro-4-methylphenyl)-4-methylimidazol-2-amine?
1-(2-fluoro-4-methylphenyl)-4-methylimidazol-2-amine has a molecular weight of 205.24 g/mol, XLogP of 2.21, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoro-4-methylphenyl)-4-methylimidazol-2-amine is sourced from PubChem (CID 106560440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).