[1-(4-fluorobenzoyl)piperidin-3-yl]-(4-phenylpiperidin-1-yl)methanone

C24H27FN2O2 — CID 134799195

IUPAC[1-(4-fluorobenzoyl)piperidin-3-yl]-(4-phenylpiperidin-1-yl)methanone
SMILESO=C(c1ccc(F)cc1)N1CCCC(C(=O)N2CCC(c3ccccc3)CC2)C1
InChIInChI=1S/C24H27FN2O2/c25-22-10-8-20(9-11-22)23(28)27-14-4-7-21(17-27)24(29)26-15-12-19(13-16-26)18-5-2-1-3-6-18/h1-3,5-6,8-11,19,21H,4,7,12-17H2
InChIKeyJKRIKOQMGSZCAQ-UHFFFAOYSA-N
MW394.49 g/mol
LogP4.08
Rot. Bonds3

About [1-(4-fluorobenzoyl)piperidin-3-yl]-(4-phenylpiperidin-1-yl)methanone

[1-(4-fluorobenzoyl)piperidin-3-yl]-(4-phenylpiperidin-1-yl)methanone (PubChem CID 134799195) has the molecular formula C24H27FN2O2 and a molecular weight of 394.49 g/mol. Its IUPAC name is [1-(4-fluorobenzoyl)piperidin-3-yl]-(4-phenylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name[1-(4-fluorobenzoyl)piperidin-3-yl]-(4-phenylpiperidin-1-yl)methanone
PubChem CID134799195
Molecular FormulaC24H27FN2O2
Molecular Weight394.49 g/mol
Exact Mass394.21
IUPAC Name[1-(4-fluorobenzoyl)piperidin-3-yl]-(4-phenylpiperidin-1-yl)methanone
SMILESO=C(c1ccc(F)cc1)N1CCCC(C(=O)N2CCC(c3ccccc3)CC2)C1
InChIInChI=1S/C24H27FN2O2/c25-22-10-8-20(9-11-22)23(28)27-14-4-7-21(17-27)24(29)26-15-12-19(13-16-26)18-5-2-1-3-6-18/h1-3,5-6,8-11,19,21H,4,7,12-17H2
InChIKeyJKRIKOQMGSZCAQ-UHFFFAOYSA-N
XLogP4.08
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.49
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze [1-(4-fluorobenzoyl)piperidin-3-yl]-(4-phenylpiperidin-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

[(3R)-1-(4-fluorobenzoyl)piperidin-3-yl]-piperidin-1-ylmethanone
CID 936701
[1-(4-fluorobenzoyl)piperidin-3-yl]-(4-hydroxypiperidin-1-yl)methanone
CID 110883925
(4-aminopiperidin-1-yl)-[1-(4-fluorobenzoyl)piperidin-3-yl]methanone
CID 119372894
(4-benzylpiperazin-1-yl)-[(3R)-1-(4-fluorobenzoyl)piperidin-3-yl]methanone
CID 25297530
1-[3-[4-(4-fluorobenzoyl)piperazine-1-carbonyl]piperidin-1-yl]-2-phenylethanone
CID 46546638
[(3R)-1-(4-fluorobenzoyl)piperidin-3-yl]-[(3S)-3-methylpiperidin-1-yl]methanone
CID 94492733
3-(4-phenylazepane-1-carbonyl)piperidine-1-carboxamide
CID 136522919
[(3S)-1-(4-fluorobenzoyl)piperidin-3-yl]-[(3S)-3-methylpiperidin-1-yl]methanone
CID 94492735
(4-fluorophenyl)-[3-(4-fluorophenyl)piperidin-1-yl]methanone
CID 70334763
[4-(1-aminoethyl)piperidin-1-yl]-[1-(4-fluorobenzoyl)piperidin-3-yl]methanone
CID 119516771
1-(azepan-1-yl)-2-[4-[1-(4-fluorobenzoyl)piperidine-3-carbonyl]piperazin-1-yl]ethanone
CID 55466088
phenyl-(3-phenylpyrrolidin-1-yl)methanone
CID 6422044

Frequently Asked Questions

What is the IUPAC name of [1-(4-fluorobenzoyl)piperidin-3-yl]-(4-phenylpiperidin-1-yl)methanone?
The IUPAC name of [1-(4-fluorobenzoyl)piperidin-3-yl]-(4-phenylpiperidin-1-yl)methanone (CID 134799195) is [1-(4-fluorobenzoyl)piperidin-3-yl]-(4-phenylpiperidin-1-yl)methanone.
What is the SMILES notation for [1-(4-fluorobenzoyl)piperidin-3-yl]-(4-phenylpiperidin-1-yl)methanone?
The canonical SMILES for [1-(4-fluorobenzoyl)piperidin-3-yl]-(4-phenylpiperidin-1-yl)methanone is O=C(c1ccc(F)cc1)N1CCCC(C(=O)N2CCC(c3ccccc3)CC2)C1.
What is the InChIKey of [1-(4-fluorobenzoyl)piperidin-3-yl]-(4-phenylpiperidin-1-yl)methanone?
The InChIKey is JKRIKOQMGSZCAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27FN2O2/c25-22-10-8-20(9-11-22)23(28)27-14-4-7-21(17-27)24(29)26-15-12-19(13-16-26)18-5-2-1-3-6-18/h1-3,5-6,8-11,19,21H,4,7,12-17H2.
What are the key properties of [1-(4-fluorobenzoyl)piperidin-3-yl]-(4-phenylpiperidin-1-yl)methanone?
[1-(4-fluorobenzoyl)piperidin-3-yl]-(4-phenylpiperidin-1-yl)methanone has a molecular weight of 394.49 g/mol, XLogP of 4.08, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-fluorobenzoyl)piperidin-3-yl]-(4-phenylpiperidin-1-yl)methanone is sourced from PubChem (CID 134799195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).