N-ethyl-4-methyl-1-[4-methyl-3-(trifluoromethyl)phenyl]imidazol-2-amine

C14H16F3N3 — CID 106568290

IUPACN-ethyl-4-methyl-1-[4-methyl-3-(trifluoromethyl)phenyl]imidazol-2-amine
SMILESCCNc1nc(C)cn1-c1ccc(C)c(C(F)(F)F)c1
InChIInChI=1S/C14H16F3N3/c1-4-18-13-19-10(3)8-20(13)11-6-5-9(2)12(7-11)14(15,16)17/h5-8H,4H2,1-3H3,(H,18,19)
InChIKeyAKRGAJHXSOFJQZ-UHFFFAOYSA-N
MW283.30 g/mol
LogP3.94
Rot. Bonds3

About N-ethyl-4-methyl-1-[4-methyl-3-(trifluoromethyl)phenyl]imidazol-2-amine

N-ethyl-4-methyl-1-[4-methyl-3-(trifluoromethyl)phenyl]imidazol-2-amine (PubChem CID 106568290) has the molecular formula C14H16F3N3 and a molecular weight of 283.30 g/mol. Its IUPAC name is N-ethyl-4-methyl-1-[4-methyl-3-(trifluoromethyl)phenyl]imidazol-2-amine.

Molecular Properties

Compound NameN-ethyl-4-methyl-1-[4-methyl-3-(trifluoromethyl)phenyl]imidazol-2-amine
PubChem CID106568290
Molecular FormulaC14H16F3N3
Molecular Weight283.30 g/mol
Exact Mass283.13
IUPAC NameN-ethyl-4-methyl-1-[4-methyl-3-(trifluoromethyl)phenyl]imidazol-2-amine
SMILESCCNc1nc(C)cn1-c1ccc(C)c(C(F)(F)F)c1
InChIInChI=1S/C14H16F3N3/c1-4-18-13-19-10(3)8-20(13)11-6-5-9(2)12(7-11)14(15,16)17/h5-8H,4H2,1-3H3,(H,18,19)
InChIKeyAKRGAJHXSOFJQZ-UHFFFAOYSA-N
XLogP3.94
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.30
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-ethoxyphenyl)-N-ethyl-4-methylimidazol-2-amine
CID 106566744
1-(3-bromo-4-fluorophenyl)-N-butyl-4-methylimidazol-2-amine
CID 106581546
N-ethyl-4-methyl-1-(1-methylpyrazol-4-yl)imidazol-2-amine
CID 106562115
1-(4-fluoro-3-methoxyphenyl)-4-methyl-N-propylimidazol-2-amine
CID 106583317
1-(3,5-difluorophenyl)-4-methyl-N-propylimidazol-2-amine
CID 106559729
1-(3-chloro-4-methylphenyl)-N-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106555475
1-(3-chloro-4-methylphenyl)-4-methyl-N-prop-2-enylimidazol-2-amine
CID 106555476
1-(3,5-dimethylphenyl)-4-methyl-N-propylimidazol-2-amine
CID 106559215
N-ethyl-1-(4-methoxy-2-methylphenyl)-4-methylimidazol-2-amine
CID 106570507
1-(2-bromo-5-fluorophenyl)-N-ethyl-4-methylimidazol-2-amine
CID 107628425
1-(3-ethylphenyl)-4-methyl-N-propylimidazol-2-amine
CID 106559811
1-(4-bromo-3-methylphenyl)-4-methyl-N-(2-methylpropyl)imidazol-2-amine
CID 106557033

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-methyl-1-[4-methyl-3-(trifluoromethyl)phenyl]imidazol-2-amine?
The IUPAC name of N-ethyl-4-methyl-1-[4-methyl-3-(trifluoromethyl)phenyl]imidazol-2-amine (CID 106568290) is N-ethyl-4-methyl-1-[4-methyl-3-(trifluoromethyl)phenyl]imidazol-2-amine.
What is the SMILES notation for N-ethyl-4-methyl-1-[4-methyl-3-(trifluoromethyl)phenyl]imidazol-2-amine?
The canonical SMILES for N-ethyl-4-methyl-1-[4-methyl-3-(trifluoromethyl)phenyl]imidazol-2-amine is CCNc1nc(C)cn1-c1ccc(C)c(C(F)(F)F)c1.
What is the InChIKey of N-ethyl-4-methyl-1-[4-methyl-3-(trifluoromethyl)phenyl]imidazol-2-amine?
The InChIKey is AKRGAJHXSOFJQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16F3N3/c1-4-18-13-19-10(3)8-20(13)11-6-5-9(2)12(7-11)14(15,16)17/h5-8H,4H2,1-3H3,(H,18,19).
What are the key properties of N-ethyl-4-methyl-1-[4-methyl-3-(trifluoromethyl)phenyl]imidazol-2-amine?
N-ethyl-4-methyl-1-[4-methyl-3-(trifluoromethyl)phenyl]imidazol-2-amine has a molecular weight of 283.30 g/mol, XLogP of 3.94, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-methyl-1-[4-methyl-3-(trifluoromethyl)phenyl]imidazol-2-amine is sourced from PubChem (CID 106568290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).