(3-fluorophenyl)-[2-(4-fluorophenyl)pyrrolidin-1-yl]methanone

C17H15F2NO — CID 50747006

IUPAC(3-fluorophenyl)-[2-(4-fluorophenyl)pyrrolidin-1-yl]methanone
SMILESO=C(c1cccc(F)c1)N1CCCC1c1ccc(F)cc1
InChIInChI=1S/C17H15F2NO/c18-14-8-6-12(7-9-14)16-5-2-10-20(16)17(21)13-3-1-4-15(19)11-13/h1,3-4,6-9,11,16H,2,5,10H2
InChIKeyZXPVBNJRRGPTHU-UHFFFAOYSA-N
MW287.31 g/mol
LogP3.94
Rot. Bonds2

About (3-fluorophenyl)-[2-(4-fluorophenyl)pyrrolidin-1-yl]methanone

(3-fluorophenyl)-[2-(4-fluorophenyl)pyrrolidin-1-yl]methanone (PubChem CID 50747006) has the molecular formula C17H15F2NO and a molecular weight of 287.31 g/mol. Its IUPAC name is (3-fluorophenyl)-[2-(4-fluorophenyl)pyrrolidin-1-yl]methanone.

Molecular Properties

Compound Name(3-fluorophenyl)-[2-(4-fluorophenyl)pyrrolidin-1-yl]methanone
PubChem CID50747006
Molecular FormulaC17H15F2NO
Molecular Weight287.31 g/mol
Exact Mass287.11
IUPAC Name(3-fluorophenyl)-[2-(4-fluorophenyl)pyrrolidin-1-yl]methanone
SMILESO=C(c1cccc(F)c1)N1CCCC1c1ccc(F)cc1
InChIInChI=1S/C17H15F2NO/c18-14-8-6-12(7-9-14)16-5-2-10-20(16)17(21)13-3-1-4-15(19)11-13/h1,3-4,6-9,11,16H,2,5,10H2
InChIKeyZXPVBNJRRGPTHU-UHFFFAOYSA-N
XLogP3.94
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.31
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (3-fluorophenyl)-[2-(4-fluorophenyl)pyrrolidin-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

[2-(4-fluorophenyl)piperidin-1-yl]-[3-(1,2,4-triazol-4-yl)phenyl]methanone
CID 70775438
2-(3-fluorophenyl)-1-[2-(4-fluorophenyl)pyrrolidin-1-yl]ethanone
CID 50747082
[(2R)-2-(4-fluorophenyl)pyrrolidin-1-yl]-thiophen-3-ylmethanone
CID 94617936
7-[(2S)-2-(4-fluorophenyl)pyrrolidine-1-carbonyl]-2-sulfanylidene-1H-quinazolin-4-one
CID 95045601
(3-fluorophenyl)-[(2R)-2-phenylpiperazin-1-yl]methanone
CID 94997806
[(2R)-2-(4-fluorophenyl)pyrrolidin-1-yl]-(3,4,5-trimethoxyphenyl)methanone
CID 32840665
N-ethyl-3-[2-(4-fluorophenyl)pyrrolidine-1-carbonyl]-N-phenylbenzenesulfonamide
CID 55530086
1-(3-fluorobenzoyl)-N-[(4-fluorophenyl)methyl]pyrrolidine-2-carboxamide
CID 46757142
[(3S,3aR,7aR)-3-(4-fluorophenyl)-4-methyl-3,3a,5,6,7,7a-hexahydro-2H-pyrrolo[3,2-b]pyridin-1-yl]-(3-fluorophenyl)methanone
CID 92608310
(3-bromophenyl)-[(2R)-2-phenylpyrrolidin-1-yl]methanone
CID 41264423
[2-(4-fluorophenyl)pyrrolidin-1-yl]-(4-nitrophenyl)methanone
CID 47019414
[2-(4-fluorophenyl)azetidin-1-yl]-[3-(1,2,4-triazol-4-yl)phenyl]methanone
CID 72928211

Frequently Asked Questions

What is the IUPAC name of (3-fluorophenyl)-[2-(4-fluorophenyl)pyrrolidin-1-yl]methanone?
The IUPAC name of (3-fluorophenyl)-[2-(4-fluorophenyl)pyrrolidin-1-yl]methanone (CID 50747006) is (3-fluorophenyl)-[2-(4-fluorophenyl)pyrrolidin-1-yl]methanone.
What is the SMILES notation for (3-fluorophenyl)-[2-(4-fluorophenyl)pyrrolidin-1-yl]methanone?
The canonical SMILES for (3-fluorophenyl)-[2-(4-fluorophenyl)pyrrolidin-1-yl]methanone is O=C(c1cccc(F)c1)N1CCCC1c1ccc(F)cc1.
What is the InChIKey of (3-fluorophenyl)-[2-(4-fluorophenyl)pyrrolidin-1-yl]methanone?
The InChIKey is ZXPVBNJRRGPTHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15F2NO/c18-14-8-6-12(7-9-14)16-5-2-10-20(16)17(21)13-3-1-4-15(19)11-13/h1,3-4,6-9,11,16H,2,5,10H2.
What are the key properties of (3-fluorophenyl)-[2-(4-fluorophenyl)pyrrolidin-1-yl]methanone?
(3-fluorophenyl)-[2-(4-fluorophenyl)pyrrolidin-1-yl]methanone has a molecular weight of 287.31 g/mol, XLogP of 3.94, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluorophenyl)-[2-(4-fluorophenyl)pyrrolidin-1-yl]methanone is sourced from PubChem (CID 50747006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).