5-(3-fluoro-4-methylphenyl)-2-methyl-3-(2-methylpropyl)imidazol-4-amine

C15H20FN3 — CID 63647032

IUPAC5-(3-fluoro-4-methylphenyl)-2-methyl-3-(2-methylpropyl)imidazol-4-amine
SMILESCc1ccc(-c2nc(C)n(CC(C)C)c2N)cc1F
InChIInChI=1S/C15H20FN3/c1-9(2)8-19-11(4)18-14(15(19)17)12-6-5-10(3)13(16)7-12/h5-7,9H,8,17H2,1-4H3
InChIKeyZEKJELSMSHUNPE-UHFFFAOYSA-N
MW261.34 g/mol
LogP3.54
Rot. Bonds3

About 5-(3-fluoro-4-methylphenyl)-2-methyl-3-(2-methylpropyl)imidazol-4-amine

5-(3-fluoro-4-methylphenyl)-2-methyl-3-(2-methylpropyl)imidazol-4-amine (PubChem CID 63647032) has the molecular formula C15H20FN3 and a molecular weight of 261.34 g/mol. Its IUPAC name is 5-(3-fluoro-4-methylphenyl)-2-methyl-3-(2-methylpropyl)imidazol-4-amine.

Molecular Properties

Compound Name5-(3-fluoro-4-methylphenyl)-2-methyl-3-(2-methylpropyl)imidazol-4-amine
PubChem CID63647032
Molecular FormulaC15H20FN3
Molecular Weight261.34 g/mol
Exact Mass261.16
IUPAC Name5-(3-fluoro-4-methylphenyl)-2-methyl-3-(2-methylpropyl)imidazol-4-amine
SMILESCc1ccc(-c2nc(C)n(CC(C)C)c2N)cc1F
InChIInChI=1S/C15H20FN3/c1-9(2)8-19-11(4)18-14(15(19)17)12-6-5-10(3)13(16)7-12/h5-7,9H,8,17H2,1-4H3
InChIKeyZEKJELSMSHUNPE-UHFFFAOYSA-N
XLogP3.54
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.34
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(3-fluoro-4-methylphenyl)-2-methyl-3-(2-methylpropyl)imidazol-4-amine?
The IUPAC name of 5-(3-fluoro-4-methylphenyl)-2-methyl-3-(2-methylpropyl)imidazol-4-amine (CID 63647032) is 5-(3-fluoro-4-methylphenyl)-2-methyl-3-(2-methylpropyl)imidazol-4-amine.
What is the SMILES notation for 5-(3-fluoro-4-methylphenyl)-2-methyl-3-(2-methylpropyl)imidazol-4-amine?
The canonical SMILES for 5-(3-fluoro-4-methylphenyl)-2-methyl-3-(2-methylpropyl)imidazol-4-amine is Cc1ccc(-c2nc(C)n(CC(C)C)c2N)cc1F.
What is the InChIKey of 5-(3-fluoro-4-methylphenyl)-2-methyl-3-(2-methylpropyl)imidazol-4-amine?
The InChIKey is ZEKJELSMSHUNPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FN3/c1-9(2)8-19-11(4)18-14(15(19)17)12-6-5-10(3)13(16)7-12/h5-7,9H,8,17H2,1-4H3.
What are the key properties of 5-(3-fluoro-4-methylphenyl)-2-methyl-3-(2-methylpropyl)imidazol-4-amine?
5-(3-fluoro-4-methylphenyl)-2-methyl-3-(2-methylpropyl)imidazol-4-amine has a molecular weight of 261.34 g/mol, XLogP of 3.54, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-fluoro-4-methylphenyl)-2-methyl-3-(2-methylpropyl)imidazol-4-amine is sourced from PubChem (CID 63647032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).