N-ethyl-1-(2-fluoro-5-methylphenyl)imidazol-2-amine

C12H14FN3 — CID 106561073

IUPACN-ethyl-1-(2-fluoro-5-methylphenyl)imidazol-2-amine
SMILESCCNc1nccn1-c1cc(C)ccc1F
InChIInChI=1S/C12H14FN3/c1-3-14-12-15-6-7-16(12)11-8-9(2)4-5-10(11)13/h4-8H,3H2,1-2H3,(H,14,15)
InChIKeyUCIRFKPSPGZDAX-UHFFFAOYSA-N
MW219.26 g/mol
LogP2.75
Rot. Bonds3

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

N-ethyl-1-(2-fluoro-5-methylphenyl)imidazol-2-amine (PubChem CID 106561073) has the molecular formula C12H14FN3 and a molecular weight of 219.26 g/mol. Its IUPAC name is N-ethyl-1-(2-fluoro-5-methylphenyl)imidazol-2-amine.

Molecular Properties

Compound NameN-ethyl-1-(2-fluoro-5-methylphenyl)imidazol-2-amine
PubChem CID106561073
Molecular FormulaC12H14FN3
Molecular Weight219.26 g/mol
Exact Mass219.12
IUPAC NameN-ethyl-1-(2-fluoro-5-methylphenyl)imidazol-2-amine
SMILESCCNc1nccn1-c1cc(C)ccc1F
InChIInChI=1S/C12H14FN3/c1-3-14-12-15-6-7-16(12)11-8-9(2)4-5-10(11)13/h4-8H,3H2,1-2H3,(H,14,15)
InChIKeyUCIRFKPSPGZDAX-UHFFFAOYSA-N
XLogP2.75
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.26
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-bromo-2-fluorophenyl)-N-ethylimidazol-2-amine
CID 106562440
1-(2-bromo-5-methylphenyl)-N-ethylimidazol-2-amine
CID 106578943
1-(2-fluoro-5-methylphenyl)-N-phenylimidazol-2-amine
CID 106561024
1-(4-bromo-2-fluorophenyl)-N-ethylimidazol-2-amine
CID 106556992
1-(2-bromo-4-chlorophenyl)-N-ethylimidazol-2-amine
CID 106577581
1-(2-bromo-4-fluorophenyl)-N-ethylimidazol-2-amine
CID 106560730
1-(2-bromophenyl)-N-ethylimidazol-2-amine
CID 106558573
1-(2,5-dimethylphenyl)-N-methylimidazol-2-amine
CID 106558210
1-(2-fluoro-5-methoxyphenyl)-N-(2-methoxyethyl)imidazol-2-amine
CID 106576999
1-[2-chloro-5-(trifluoromethyl)phenyl]-N-ethylimidazol-2-amine
CID 106557968
1-(2-chloro-5-methylphenyl)-N-methylimidazol-2-amine
CID 107628225
N-butyl-1-(2,3,4-trifluorophenyl)imidazol-2-amine
CID 106556796

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(2-fluoro-5-methylphenyl)imidazol-2-amine?
The IUPAC name of N-ethyl-1-(2-fluoro-5-methylphenyl)imidazol-2-amine (CID 106561073) is N-ethyl-1-(2-fluoro-5-methylphenyl)imidazol-2-amine.
What is the SMILES notation for N-ethyl-1-(2-fluoro-5-methylphenyl)imidazol-2-amine?
The canonical SMILES for N-ethyl-1-(2-fluoro-5-methylphenyl)imidazol-2-amine is CCNc1nccn1-c1cc(C)ccc1F.
What is the InChIKey of N-ethyl-1-(2-fluoro-5-methylphenyl)imidazol-2-amine?
The InChIKey is UCIRFKPSPGZDAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FN3/c1-3-14-12-15-6-7-16(12)11-8-9(2)4-5-10(11)13/h4-8H,3H2,1-2H3,(H,14,15).
What are the key properties of N-ethyl-1-(2-fluoro-5-methylphenyl)imidazol-2-amine?
N-ethyl-1-(2-fluoro-5-methylphenyl)imidazol-2-amine has a molecular weight of 219.26 g/mol, XLogP of 2.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(2-fluoro-5-methylphenyl)imidazol-2-amine is sourced from PubChem (CID 106561073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).