1-(4-fluorophenyl)-2-imidazol-1-ylethanamine

C11H12FN3 — CID 16787972

IUPAC1-(4-fluorophenyl)-2-imidazol-1-ylethanamine
SMILESNC(Cn1ccnc1)c1ccc(F)cc1
InChIInChI=1S/C11H12FN3/c12-10-3-1-9(2-4-10)11(13)7-15-6-5-14-8-15/h1-6,8,11H,7,13H2
InChIKeyZZEGPMGJGOVVFB-UHFFFAOYSA-N
MW205.24 g/mol
LogP1.72
Rot. Bonds3

About 1-(4-fluorophenyl)-2-imidazol-1-ylethanamine

1-(4-fluorophenyl)-2-imidazol-1-ylethanamine (PubChem CID 16787972) has the molecular formula C11H12FN3 and a molecular weight of 205.24 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-2-imidazol-1-ylethanamine.

Molecular Properties

Compound Name1-(4-fluorophenyl)-2-imidazol-1-ylethanamine
PubChem CID16787972
Molecular FormulaC11H12FN3
Molecular Weight205.24 g/mol
Exact Mass205.10
IUPAC Name1-(4-fluorophenyl)-2-imidazol-1-ylethanamine
SMILESNC(Cn1ccnc1)c1ccc(F)cc1
InChIInChI=1S/C11H12FN3/c12-10-3-1-9(2-4-10)11(13)7-15-6-5-14-8-15/h1-6,8,11H,7,13H2
InChIKeyZZEGPMGJGOVVFB-UHFFFAOYSA-N
XLogP1.72
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.24
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(4-fluorophenyl)-2-imidazol-1-ylethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-imidazol-1-yl-1-phenylethanamine
CID 5195236
1-[2-(4-fluorophenyl)-2-phenylethyl]imidazole
CID 14211259
2-imidazol-1-yl-1-(4-propan-2-yloxyphenyl)ethanamine
CID 16786819
2-imidazol-1-yl-1-thiophen-3-ylethanamine
CID 130835014
1-(3,4-dimethoxyphenyl)-2-imidazol-1-ylethanamine
CID 16641649
1-(4-fluorophenyl)-N-(1-imidazol-1-ylpropan-2-yl)propan-1-amine
CID 43749780
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-imidazol-1-ylethanamine
CID 16641652
1-(4-fluorophenyl)-2-(3-methylpyrazol-1-yl)ethanamine
CID 107522751
1-[4-(4-fluorophenoxy)phenyl]-3-imidazol-1-yl-2-methylpropan-1-ol
CID 70526340
2-imidazol-1-yl-1-(3-methoxyphenyl)ethanamine
CID 16641645
N-[1-(4-fluorophenyl)-2-imidazol-1-ylethyl]-2-methylbut-3-en-1-amine
CID 166310142
1-[2-chloro-2-(2,4-difluorophenyl)ethyl]imidazole
CID 21402230

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-2-imidazol-1-ylethanamine?
The IUPAC name of 1-(4-fluorophenyl)-2-imidazol-1-ylethanamine (CID 16787972) is 1-(4-fluorophenyl)-2-imidazol-1-ylethanamine.
What is the SMILES notation for 1-(4-fluorophenyl)-2-imidazol-1-ylethanamine?
The canonical SMILES for 1-(4-fluorophenyl)-2-imidazol-1-ylethanamine is NC(Cn1ccnc1)c1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-2-imidazol-1-ylethanamine?
The InChIKey is ZZEGPMGJGOVVFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FN3/c12-10-3-1-9(2-4-10)11(13)7-15-6-5-14-8-15/h1-6,8,11H,7,13H2.
What are the key properties of 1-(4-fluorophenyl)-2-imidazol-1-ylethanamine?
1-(4-fluorophenyl)-2-imidazol-1-ylethanamine has a molecular weight of 205.24 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-2-imidazol-1-ylethanamine is sourced from PubChem (CID 16787972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).