5-[[3-[(3-fluoro-4-methylphenyl)methyl]pyrrolidin-1-yl]methyl]-1-(2-methoxyethyl)imidazole

C19H26FN3O — CID 166615769

IUPAC5-[[3-[(3-fluoro-4-methylphenyl)methyl]pyrrolidin-1-yl]methyl]-1-(2-methoxyethyl)imidazole
SMILESCOCCn1cncc1CN1CCC(Cc2ccc(C)c(F)c2)C1
InChIInChI=1S/C19H26FN3O/c1-15-3-4-16(10-19(15)20)9-17-5-6-22(12-17)13-18-11-21-14-23(18)7-8-24-2/h3-4,10-11,14,17H,5-9,12-13H2,1-2H3
InChIKeyUZDHOSSBJWPXNY-UHFFFAOYSA-N
MW331.44 g/mol
LogP3.04
Rot. Bonds7

About 5-[[3-[(3-fluoro-4-methylphenyl)methyl]pyrrolidin-1-yl]methyl]-1-(2-methoxyethyl)imidazole

5-[[3-[(3-fluoro-4-methylphenyl)methyl]pyrrolidin-1-yl]methyl]-1-(2-methoxyethyl)imidazole (PubChem CID 166615769) has the molecular formula C19H26FN3O and a molecular weight of 331.44 g/mol. Its IUPAC name is 5-[[3-[(3-fluoro-4-methylphenyl)methyl]pyrrolidin-1-yl]methyl]-1-(2-methoxyethyl)imidazole.

Molecular Properties

Compound Name5-[[3-[(3-fluoro-4-methylphenyl)methyl]pyrrolidin-1-yl]methyl]-1-(2-methoxyethyl)imidazole
PubChem CID166615769
Molecular FormulaC19H26FN3O
Molecular Weight331.44 g/mol
Exact Mass331.21
IUPAC Name5-[[3-[(3-fluoro-4-methylphenyl)methyl]pyrrolidin-1-yl]methyl]-1-(2-methoxyethyl)imidazole
SMILESCOCCn1cncc1CN1CCC(Cc2ccc(C)c(F)c2)C1
InChIInChI=1S/C19H26FN3O/c1-15-3-4-16(10-19(15)20)9-17-5-6-22(12-17)13-18-11-21-14-23(18)7-8-24-2/h3-4,10-11,14,17H,5-9,12-13H2,1-2H3
InChIKeyUZDHOSSBJWPXNY-UHFFFAOYSA-N
XLogP3.04
TPSA30.29 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.44
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-[[3-[(3-fluoro-4-methylphenyl)methyl]pyrrolidin-1-yl]methyl]-1-(2-methoxyethyl)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

3-[(4-fluorophenyl)methyl]-1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidine
CID 91829440
5-[[3-(2-chlorophenyl)pyrrolidin-1-yl]methyl]-1-(2-methoxyethyl)imidazole
CID 91840373
5-[[(3R)-3-(2-chlorophenyl)pyrrolidin-1-yl]methyl]-1-(2-methoxyethyl)imidazole
CID 124753499
dimethyl 1-[2-[3-[(3-fluoro-4-methylphenyl)methyl]pyrrolidin-1-yl]ethyl]pyrazole-3,5-dicarboxylate
CID 166620199
1-[1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]azetidin-3-yl]-3,5-dimethylpyrazole
CID 91832467
6-fluoro-2-[1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-4-yl]-1H-benzimidazole
CID 91834299
(2S)-2-(4-chlorophenyl)-4-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]morpholine
CID 95550441
4-[[3-[(3-fluoro-4-methylphenyl)methyl]pyrrolidin-1-yl]methyl]-3,5-dimethyl-1,2-oxazole;formic acid
CID 171710230
(3aR,6aS)-2-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-ol
CID 139599274
(3S)-1-[(3-fluoro-4-methylphenyl)methyl]pyrrolidin-3-ol
CID 103883025
1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-(2-methylphenyl)-1,4-diazepane
CID 135095673
1-[1-[(3-fluoro-4-methylphenyl)methyl]piperidin-4-yl]-N-methylmethanamine
CID 63649779

Frequently Asked Questions

What is the IUPAC name of 5-[[3-[(3-fluoro-4-methylphenyl)methyl]pyrrolidin-1-yl]methyl]-1-(2-methoxyethyl)imidazole?
The IUPAC name of 5-[[3-[(3-fluoro-4-methylphenyl)methyl]pyrrolidin-1-yl]methyl]-1-(2-methoxyethyl)imidazole (CID 166615769) is 5-[[3-[(3-fluoro-4-methylphenyl)methyl]pyrrolidin-1-yl]methyl]-1-(2-methoxyethyl)imidazole.
What is the SMILES notation for 5-[[3-[(3-fluoro-4-methylphenyl)methyl]pyrrolidin-1-yl]methyl]-1-(2-methoxyethyl)imidazole?
The canonical SMILES for 5-[[3-[(3-fluoro-4-methylphenyl)methyl]pyrrolidin-1-yl]methyl]-1-(2-methoxyethyl)imidazole is COCCn1cncc1CN1CCC(Cc2ccc(C)c(F)c2)C1.
What is the InChIKey of 5-[[3-[(3-fluoro-4-methylphenyl)methyl]pyrrolidin-1-yl]methyl]-1-(2-methoxyethyl)imidazole?
The InChIKey is UZDHOSSBJWPXNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26FN3O/c1-15-3-4-16(10-19(15)20)9-17-5-6-22(12-17)13-18-11-21-14-23(18)7-8-24-2/h3-4,10-11,14,17H,5-9,12-13H2,1-2H3.
What are the key properties of 5-[[3-[(3-fluoro-4-methylphenyl)methyl]pyrrolidin-1-yl]methyl]-1-(2-methoxyethyl)imidazole?
5-[[3-[(3-fluoro-4-methylphenyl)methyl]pyrrolidin-1-yl]methyl]-1-(2-methoxyethyl)imidazole has a molecular weight of 331.44 g/mol, XLogP of 3.04, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[3-[(3-fluoro-4-methylphenyl)methyl]pyrrolidin-1-yl]methyl]-1-(2-methoxyethyl)imidazole is sourced from PubChem (CID 166615769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).