5-cyclopropyl-1-[(4-fluorophenyl)methyl]imidazole

C13H13FN2 — CID 116811649

IUPAC5-cyclopropyl-1-[(4-fluorophenyl)methyl]imidazole
SMILESFc1ccc(Cn2cncc2C2CC2)cc1
InChIInChI=1S/C13H13FN2/c14-12-5-1-10(2-6-12)8-16-9-15-7-13(16)11-3-4-11/h1-2,5-7,9,11H,3-4,8H2
InChIKeyZOYRZTWEQYRNML-UHFFFAOYSA-N
MW216.26 g/mol
LogP2.95
Rot. Bonds3

About 5-cyclopropyl-1-[(4-fluorophenyl)methyl]imidazole

5-cyclopropyl-1-[(4-fluorophenyl)methyl]imidazole (PubChem CID 116811649) has the molecular formula C13H13FN2 and a molecular weight of 216.26 g/mol. Its IUPAC name is 5-cyclopropyl-1-[(4-fluorophenyl)methyl]imidazole.

Molecular Properties

Compound Name5-cyclopropyl-1-[(4-fluorophenyl)methyl]imidazole
PubChem CID116811649
Molecular FormulaC13H13FN2
Molecular Weight216.26 g/mol
Exact Mass216.11
IUPAC Name5-cyclopropyl-1-[(4-fluorophenyl)methyl]imidazole
SMILESFc1ccc(Cn2cncc2C2CC2)cc1
InChIInChI=1S/C13H13FN2/c14-12-5-1-10(2-6-12)8-16-9-15-7-13(16)11-3-4-11/h1-2,5-7,9,11H,3-4,8H2
InChIKeyZOYRZTWEQYRNML-UHFFFAOYSA-N
XLogP2.95
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.26
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5-cyclopropyl-1-[(4-fluorophenyl)methyl]imidazole 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

4-[(5-piperidin-4-ylimidazol-1-yl)methyl]pyridine
CID 114703940
4-[3-[(4-fluoro-3,5-dimethylphenyl)methyl]imidazol-4-yl]piperidine
CID 114706757
3-[3-[(3,4-difluorophenyl)methyl]imidazol-4-yl]piperidine
CID 114704736
3-[3-[2-(4-fluorophenyl)ethyl]imidazol-4-yl]piperidine
CID 114703121
1-[(2,5-difluorophenyl)methyl]-5-pyrrolidin-3-ylimidazole
CID 114720616
2-chloro-5-[2-(5-cyclopropylimidazol-1-yl)ethyl]pyridine
CID 116811691
4-[3-[2-(4-chlorophenyl)ethyl]imidazol-4-yl]piperidine
CID 114704864
4-[[5-[(2S)-pyrrolidin-2-yl]imidazol-1-yl]methyl]pyridine
CID 104942141
5-cyclopropyl-1-[(2,4-dimethylphenyl)methyl]imidazole
CID 116811663
1-[(4-methoxyphenyl)methyl]-5-pyrrolidin-2-ylimidazole
CID 114702895
1-[(4-methoxyphenyl)methyl]-5-[(2S)-pyrrolidin-2-yl]imidazole
CID 104941677
5-cyclopropyl-1-[(4-fluorophenyl)methyl]pyrazole-3-carboxylic acid
CID 82301432

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-1-[(4-fluorophenyl)methyl]imidazole?
The IUPAC name of 5-cyclopropyl-1-[(4-fluorophenyl)methyl]imidazole (CID 116811649) is 5-cyclopropyl-1-[(4-fluorophenyl)methyl]imidazole.
What is the SMILES notation for 5-cyclopropyl-1-[(4-fluorophenyl)methyl]imidazole?
The canonical SMILES for 5-cyclopropyl-1-[(4-fluorophenyl)methyl]imidazole is Fc1ccc(Cn2cncc2C2CC2)cc1.
What is the InChIKey of 5-cyclopropyl-1-[(4-fluorophenyl)methyl]imidazole?
The InChIKey is ZOYRZTWEQYRNML-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FN2/c14-12-5-1-10(2-6-12)8-16-9-15-7-13(16)11-3-4-11/h1-2,5-7,9,11H,3-4,8H2.
What are the key properties of 5-cyclopropyl-1-[(4-fluorophenyl)methyl]imidazole?
5-cyclopropyl-1-[(4-fluorophenyl)methyl]imidazole has a molecular weight of 216.26 g/mol, XLogP of 2.95, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-1-[(4-fluorophenyl)methyl]imidazole is sourced from PubChem (CID 116811649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).