(4-fluorophenyl)-[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]methanone

C17H21FN2O2 — CID 50852464

IUPAC(4-fluorophenyl)-[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]methanone
SMILESO=C(c1ccc(F)cc1)C1CCN(C(=O)C2CCCN2)CC1
InChIInChI=1S/C17H21FN2O2/c18-14-5-3-12(4-6-14)16(21)13-7-10-20(11-8-13)17(22)15-2-1-9-19-15/h3-6,13,15,19H,1-2,7-11H2
InChIKeyIJEJPEPGBIXYKI-UHFFFAOYSA-N
MW304.36 g/mol
LogP2.00
Rot. Bonds3

About (4-fluorophenyl)-[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]methanone

(4-fluorophenyl)-[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]methanone (PubChem CID 50852464) has the molecular formula C17H21FN2O2 and a molecular weight of 304.36 g/mol. Its IUPAC name is (4-fluorophenyl)-[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]methanone.

Molecular Properties

Compound Name(4-fluorophenyl)-[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]methanone
PubChem CID50852464
Molecular FormulaC17H21FN2O2
Molecular Weight304.36 g/mol
Exact Mass304.16
IUPAC Name(4-fluorophenyl)-[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]methanone
SMILESO=C(c1ccc(F)cc1)C1CCN(C(=O)C2CCCN2)CC1
InChIInChI=1S/C17H21FN2O2/c18-14-5-3-12(4-6-14)16(21)13-7-10-20(11-8-13)17(22)15-2-1-9-19-15/h3-6,13,15,19H,1-2,7-11H2
InChIKeyIJEJPEPGBIXYKI-UHFFFAOYSA-N
XLogP2.00
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.36
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (4-fluorophenyl)-[1-(pyrrolidine-2-carbonyl)piperidin-4-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

[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]-(2,4,6-trifluorophenyl)methanone
CID 119326130
pyrrolidin-1-yl(pyrrolidin-2-yl)methanone
CID 550904
(4-fluorophenyl)-[1-(spiro[3.5]nonane-7-carbonyl)piperidin-4-yl]methanone
CID 154877652
1-[(2S)-pyrrolidine-2-carbonyl]piperidine-4-carboxamide
CID 7175999
[4-(4-fluorophenyl)piperazin-1-yl]-piperidin-2-ylmethanone;dihydrochloride
CID 119827491
[4-[(R)-(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]-[(2R)-piperidin-2-yl]methanone
CID 125151598
[4-(2,4-difluorophenoxy)piperidin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone
CID 124698879
[4-[3-(4-fluorophenyl)-1H-1,2,4-triazol-5-yl]piperidin-1-yl]-pyrrolidin-2-ylmethanone
CID 53192468
N-cyclohexyl-4-(4-fluorobenzoyl)piperidine-1-carboxamide
CID 3223565
(4-chlorophenyl)-[1-(1,3-thiazolidine-4-carbonyl)piperidin-4-yl]methanone
CID 119289949
[4-[(3-fluorophenyl)methyl]piperidin-1-yl]-pyrrolidin-2-ylmethanone
CID 119296749
(4-aminopiperidin-1-yl)-[(2S)-pyrrolidin-2-yl]methanone
CID 131224010

Frequently Asked Questions

What is the IUPAC name of (4-fluorophenyl)-[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]methanone?
The IUPAC name of (4-fluorophenyl)-[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]methanone (CID 50852464) is (4-fluorophenyl)-[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]methanone.
What is the SMILES notation for (4-fluorophenyl)-[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]methanone?
The canonical SMILES for (4-fluorophenyl)-[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]methanone is O=C(c1ccc(F)cc1)C1CCN(C(=O)C2CCCN2)CC1.
What is the InChIKey of (4-fluorophenyl)-[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]methanone?
The InChIKey is IJEJPEPGBIXYKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21FN2O2/c18-14-5-3-12(4-6-14)16(21)13-7-10-20(11-8-13)17(22)15-2-1-9-19-15/h3-6,13,15,19H,1-2,7-11H2.
What are the key properties of (4-fluorophenyl)-[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]methanone?
(4-fluorophenyl)-[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]methanone has a molecular weight of 304.36 g/mol, XLogP of 2.00, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluorophenyl)-[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]methanone is sourced from PubChem (CID 50852464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).