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

C18H18FNO — CID 50747381

IUPAC(3-fluorophenyl)-[2-(2-methylphenyl)pyrrolidin-1-yl]methanone
SMILESCc1ccccc1C1CCCN1C(=O)c1cccc(F)c1
InChIInChI=1S/C18H18FNO/c1-13-6-2-3-9-16(13)17-10-5-11-20(17)18(21)14-7-4-8-15(19)12-14/h2-4,6-9,12,17H,5,10-11H2,1H3
InChIKeyZUGHIEZJJFQDNG-UHFFFAOYSA-N
MW283.35 g/mol
LogP4.11
Rot. Bonds2

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

(3-fluorophenyl)-[2-(2-methylphenyl)pyrrolidin-1-yl]methanone (PubChem CID 50747381) has the molecular formula C18H18FNO and a molecular weight of 283.35 g/mol. Its IUPAC name is (3-fluorophenyl)-[2-(2-methylphenyl)pyrrolidin-1-yl]methanone.

Molecular Properties

Compound Name(3-fluorophenyl)-[2-(2-methylphenyl)pyrrolidin-1-yl]methanone
PubChem CID50747381
Molecular FormulaC18H18FNO
Molecular Weight283.35 g/mol
Exact Mass283.14
IUPAC Name(3-fluorophenyl)-[2-(2-methylphenyl)pyrrolidin-1-yl]methanone
SMILESCc1ccccc1C1CCCN1C(=O)c1cccc(F)c1
InChIInChI=1S/C18H18FNO/c1-13-6-2-3-9-16(13)17-10-5-11-20(17)18(21)14-7-4-8-15(19)12-14/h2-4,6-9,12,17H,5,10-11H2,1H3
InChIKeyZUGHIEZJJFQDNG-UHFFFAOYSA-N
XLogP4.11
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.35
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (3-fluorophenyl)-[2-(2-methylphenyl)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-Methyl-N,N-diethylbenzamide
CID 75945
2-((1-(2-(4-Fluorophenyl)-2-oxoethyl)-4-piperidinyl)methyl)-2,3-dihydro-1H-isoindol-1-one
CID 9799284
Isopropylphthalimide
CID 67535
Bunaftine
CID 36131
N,N,N',N'-Tetraethylphthalamide
CID 66526
Pyrrolidine, 1-(o-benzoylbenzoyl)-
CID 208220
4-Benzyl-1-(3-methylbenzoyl)piperidine
CID 1378917
alpha-Phthalimidopropiophenone
CID 519663
N-Cyclohexylphthalimide
CID 225739
N-{[(2S)-1-[(3R)-3-amino-4-(2-fluorophenyl)butanoyl]pyrrolidin-2-yl]methyl}benzamide
CID 5494422
1-(2,6-Difluorobenzoyl)pyrrolidine
CID 588246
N-(4-Methylbenzoyl)-4-benzylpiperidine
CID 1415427

Frequently Asked Questions

What is the IUPAC name of (3-fluorophenyl)-[2-(2-methylphenyl)pyrrolidin-1-yl]methanone?
The IUPAC name of (3-fluorophenyl)-[2-(2-methylphenyl)pyrrolidin-1-yl]methanone (CID 50747381) is (3-fluorophenyl)-[2-(2-methylphenyl)pyrrolidin-1-yl]methanone.
What is the SMILES notation for (3-fluorophenyl)-[2-(2-methylphenyl)pyrrolidin-1-yl]methanone?
The canonical SMILES for (3-fluorophenyl)-[2-(2-methylphenyl)pyrrolidin-1-yl]methanone is Cc1ccccc1C1CCCN1C(=O)c1cccc(F)c1.
What is the InChIKey of (3-fluorophenyl)-[2-(2-methylphenyl)pyrrolidin-1-yl]methanone?
The InChIKey is ZUGHIEZJJFQDNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18FNO/c1-13-6-2-3-9-16(13)17-10-5-11-20(17)18(21)14-7-4-8-15(19)12-14/h2-4,6-9,12,17H,5,10-11H2,1H3.
What are the key properties of (3-fluorophenyl)-[2-(2-methylphenyl)pyrrolidin-1-yl]methanone?
(3-fluorophenyl)-[2-(2-methylphenyl)pyrrolidin-1-yl]methanone has a molecular weight of 283.35 g/mol, XLogP of 4.11, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluorophenyl)-[2-(2-methylphenyl)pyrrolidin-1-yl]methanone is sourced from PubChem (CID 50747381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).