[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]-(2,4,6-trifluorophenyl)methanone

C17H19F3N2O2 — CID 119326130

IUPAC[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]-(2,4,6-trifluorophenyl)methanone
SMILESO=C(c1c(F)cc(F)cc1F)C1CCN(C(=O)C2CCCN2)CC1
InChIInChI=1S/C17H19F3N2O2/c18-11-8-12(19)15(13(20)9-11)16(23)10-3-6-22(7-4-10)17(24)14-2-1-5-21-14/h8-10,14,21H,1-7H2
InChIKeyAOMVGFUHNGUJHJ-UHFFFAOYSA-N
MW340.35 g/mol
LogP2.28
Rot. Bonds3

About [1-(pyrrolidine-2-carbonyl)piperidin-4-yl]-(2,4,6-trifluorophenyl)methanone

[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]-(2,4,6-trifluorophenyl)methanone (PubChem CID 119326130) has the molecular formula C17H19F3N2O2 and a molecular weight of 340.35 g/mol. Its IUPAC name is [1-(pyrrolidine-2-carbonyl)piperidin-4-yl]-(2,4,6-trifluorophenyl)methanone.

Molecular Properties

Compound Name[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]-(2,4,6-trifluorophenyl)methanone
PubChem CID119326130
Molecular FormulaC17H19F3N2O2
Molecular Weight340.35 g/mol
Exact Mass340.14
IUPAC Name[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]-(2,4,6-trifluorophenyl)methanone
SMILESO=C(c1c(F)cc(F)cc1F)C1CCN(C(=O)C2CCCN2)CC1
InChIInChI=1S/C17H19F3N2O2/c18-11-8-12(19)15(13(20)9-11)16(23)10-3-6-22(7-4-10)17(24)14-2-1-5-21-14/h8-10,14,21H,1-7H2
InChIKeyAOMVGFUHNGUJHJ-UHFFFAOYSA-N
XLogP2.28
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.35
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-(pyrrolidine-2-carbonyl)piperidin-4-yl]-(2,4,6-trifluorophenyl)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

(4-fluorophenyl)-[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]methanone
CID 50852464
[1-(pyrrolidine-3-carbonyl)piperidin-4-yl]-(2,4,6-trifluorophenyl)methanone
CID 119787931
2-pyrrolidin-2-yl-1-[4-(2,4,6-trifluorobenzoyl)piperidin-1-yl]ethanone;hydrochloride
CID 119787926
[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]-(2,4,6-trifluorophenyl)methanone
CID 120933033
pyrrolidin-1-yl(pyrrolidin-2-yl)methanone
CID 550904
[4-(2,4-difluorophenoxy)piperidin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone
CID 124698879
1-[(2S)-pyrrolidine-2-carbonyl]piperidine-4-carboxamide
CID 7175999
[4-[(3-fluorophenyl)methyl]piperidin-1-yl]-pyrrolidin-2-ylmethanone
CID 119296749
(4-aminopiperidin-1-yl)-pyrrolidin-2-ylmethanone
CID 110461351
(4-aminopiperidin-1-yl)-[(2S)-pyrrolidin-2-yl]methanone
CID 131224010
cyclopropyl-[4-[(2S)-pyrrolidine-2-carbonyl]piperazin-1-yl]methanone;hydrochloride
CID 71888790
azepan-1-yl(azepan-2-yl)methanone
CID 64562203

Frequently Asked Questions

What is the IUPAC name of [1-(pyrrolidine-2-carbonyl)piperidin-4-yl]-(2,4,6-trifluorophenyl)methanone?
The IUPAC name of [1-(pyrrolidine-2-carbonyl)piperidin-4-yl]-(2,4,6-trifluorophenyl)methanone (CID 119326130) is [1-(pyrrolidine-2-carbonyl)piperidin-4-yl]-(2,4,6-trifluorophenyl)methanone.
What is the SMILES notation for [1-(pyrrolidine-2-carbonyl)piperidin-4-yl]-(2,4,6-trifluorophenyl)methanone?
The canonical SMILES for [1-(pyrrolidine-2-carbonyl)piperidin-4-yl]-(2,4,6-trifluorophenyl)methanone is O=C(c1c(F)cc(F)cc1F)C1CCN(C(=O)C2CCCN2)CC1.
What is the InChIKey of [1-(pyrrolidine-2-carbonyl)piperidin-4-yl]-(2,4,6-trifluorophenyl)methanone?
The InChIKey is AOMVGFUHNGUJHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19F3N2O2/c18-11-8-12(19)15(13(20)9-11)16(23)10-3-6-22(7-4-10)17(24)14-2-1-5-21-14/h8-10,14,21H,1-7H2.
What are the key properties of [1-(pyrrolidine-2-carbonyl)piperidin-4-yl]-(2,4,6-trifluorophenyl)methanone?
[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]-(2,4,6-trifluorophenyl)methanone has a molecular weight of 340.35 g/mol, XLogP of 2.28, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(pyrrolidine-2-carbonyl)piperidin-4-yl]-(2,4,6-trifluorophenyl)methanone is sourced from PubChem (CID 119326130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).