[1-(4-fluorophenyl)cyclobutyl]-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone

C19H22FN3O — CID 95339238

IUPAC[1-(4-fluorophenyl)cyclobutyl]-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone
SMILESO=C(N1CCC[C@@H](n2ccnc2)C1)C1(c2ccc(F)cc2)CCC1
InChIInChI=1S/C19H22FN3O/c20-16-6-4-15(5-7-16)19(8-2-9-19)18(24)22-11-1-3-17(13-22)23-12-10-21-14-23/h4-7,10,12,14,17H,1-3,8-9,11,13H2/t17-/m1/s1
InChIKeyOEMDOSLUJJECTR-QGZVFWFLSA-N
MW327.40 g/mol
LogP3.31
Rot. Bonds3

About [1-(4-fluorophenyl)cyclobutyl]-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone

[1-(4-fluorophenyl)cyclobutyl]-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone (PubChem CID 95339238) has the molecular formula C19H22FN3O and a molecular weight of 327.40 g/mol. Its IUPAC name is [1-(4-fluorophenyl)cyclobutyl]-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone.

Molecular Properties

Compound Name[1-(4-fluorophenyl)cyclobutyl]-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone
PubChem CID95339238
Molecular FormulaC19H22FN3O
Molecular Weight327.40 g/mol
Exact Mass327.17
IUPAC Name[1-(4-fluorophenyl)cyclobutyl]-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone
SMILESO=C(N1CCC[C@@H](n2ccnc2)C1)C1(c2ccc(F)cc2)CCC1
InChIInChI=1S/C19H22FN3O/c20-16-6-4-15(5-7-16)19(8-2-9-19)18(24)22-11-1-3-17(13-22)23-12-10-21-14-23/h4-7,10,12,14,17H,1-3,8-9,11,13H2/t17-/m1/s1
InChIKeyOEMDOSLUJJECTR-QGZVFWFLSA-N
XLogP3.31
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.40
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze [1-(4-fluorophenyl)cyclobutyl]-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone 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

[(3S)-3-(aminomethyl)piperidin-1-yl]-[1-(4-fluorophenyl)cyclopentyl]methanone
CID 97325169
[1-(4-fluorophenyl)cyclopentyl]-[3-(methylaminomethyl)piperidin-1-yl]methanone
CID 119398088
[1-(4-fluorophenyl)cyclopropyl]-imidazol-1-ylmethanone
CID 110464029
N-cyclopropyl-1-[1-(4-fluorophenyl)cyclopentanecarbonyl]piperidine-3-carboxamide
CID 49352658
[(3R)-3-imidazol-1-ylpiperidin-1-yl]-[(1R,2S)-2-(trifluoromethyl)cyclohexyl]methanone
CID 95341230
1-[(3R)-3-imidazol-1-ylpiperidin-1-yl]-2-(4-pyrazol-1-ylphenyl)ethanone
CID 95346883
(3-cyclopropylthiophen-2-yl)-[(3S)-3-imidazol-1-ylpiperidin-1-yl]methanone
CID 95340985
5-[(3S)-3-imidazol-1-ylpiperidine-1-carbonyl]thiophene-2-carboxamide
CID 95319281
(1-phenylcyclopropyl)-[(3S)-3-(1,2,4-triazol-1-yl)piperidin-1-yl]methanone
CID 95761368
N-[1-[1-(4-fluorophenyl)cyclopropanecarbonyl]piperidin-3-yl]methanesulfonamide
CID 56812467
(2-fluoro-4-methoxyphenyl)-[(3S)-3-imidazol-1-ylpiperidin-1-yl]methanone
CID 95341019
1-[(3R)-3-imidazol-1-ylpiperidin-1-yl]-2-[2-(trifluoromethyl)phenyl]ethanone
CID 95317069

Frequently Asked Questions

What is the IUPAC name of [1-(4-fluorophenyl)cyclobutyl]-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone?
The IUPAC name of [1-(4-fluorophenyl)cyclobutyl]-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone (CID 95339238) is [1-(4-fluorophenyl)cyclobutyl]-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone.
What is the SMILES notation for [1-(4-fluorophenyl)cyclobutyl]-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone?
The canonical SMILES for [1-(4-fluorophenyl)cyclobutyl]-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone is O=C(N1CCC[C@@H](n2ccnc2)C1)C1(c2ccc(F)cc2)CCC1.
What is the InChIKey of [1-(4-fluorophenyl)cyclobutyl]-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone?
The InChIKey is OEMDOSLUJJECTR-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H22FN3O/c20-16-6-4-15(5-7-16)19(8-2-9-19)18(24)22-11-1-3-17(13-22)23-12-10-21-14-23/h4-7,10,12,14,17H,1-3,8-9,11,13H2/t17-/m1/s1.
What are the key properties of [1-(4-fluorophenyl)cyclobutyl]-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone?
[1-(4-fluorophenyl)cyclobutyl]-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone has a molecular weight of 327.40 g/mol, XLogP of 3.31, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-fluorophenyl)cyclobutyl]-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone is sourced from PubChem (CID 95339238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).