(2,6-difluorophenyl)-[2-(2-hydroxycyclopentyl)pyrrolidin-1-yl]methanone

C16H19F2NO2 — CID 79539009

IUPAC(2,6-difluorophenyl)-[2-(2-hydroxycyclopentyl)pyrrolidin-1-yl]methanone
SMILESO=C(c1c(F)cccc1F)N1CCCC1C1CCCC1O
InChIInChI=1S/C16H19F2NO2/c17-11-5-2-6-12(18)15(11)16(21)19-9-3-7-13(19)10-4-1-8-14(10)20/h2,5-6,10,13-14,20H,1,3-4,7-9H2
InChIKeyWUBXUFXGXCWZRC-UHFFFAOYSA-N
MW295.33 g/mol
LogP2.73
Rot. Bonds2

About (2,6-difluorophenyl)-[2-(2-hydroxycyclopentyl)pyrrolidin-1-yl]methanone

(2,6-difluorophenyl)-[2-(2-hydroxycyclopentyl)pyrrolidin-1-yl]methanone (PubChem CID 79539009) has the molecular formula C16H19F2NO2 and a molecular weight of 295.33 g/mol. Its IUPAC name is (2,6-difluorophenyl)-[2-(2-hydroxycyclopentyl)pyrrolidin-1-yl]methanone.

Molecular Properties

Compound Name(2,6-difluorophenyl)-[2-(2-hydroxycyclopentyl)pyrrolidin-1-yl]methanone
PubChem CID79539009
Molecular FormulaC16H19F2NO2
Molecular Weight295.33 g/mol
Exact Mass295.14
IUPAC Name(2,6-difluorophenyl)-[2-(2-hydroxycyclopentyl)pyrrolidin-1-yl]methanone
SMILESO=C(c1c(F)cccc1F)N1CCCC1C1CCCC1O
InChIInChI=1S/C16H19F2NO2/c17-11-5-2-6-12(18)15(11)16(21)19-9-3-7-13(19)10-4-1-8-14(10)20/h2,5-6,10,13-14,20H,1,3-4,7-9H2
InChIKeyWUBXUFXGXCWZRC-UHFFFAOYSA-N
XLogP2.73
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.33
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2,6-difluorophenyl)-[2-(2-hydroxycyclopentyl)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

Frequently Asked Questions

What is the IUPAC name of (2,6-difluorophenyl)-[2-(2-hydroxycyclopentyl)pyrrolidin-1-yl]methanone?
The IUPAC name of (2,6-difluorophenyl)-[2-(2-hydroxycyclopentyl)pyrrolidin-1-yl]methanone (CID 79539009) is (2,6-difluorophenyl)-[2-(2-hydroxycyclopentyl)pyrrolidin-1-yl]methanone.
What is the SMILES notation for (2,6-difluorophenyl)-[2-(2-hydroxycyclopentyl)pyrrolidin-1-yl]methanone?
The canonical SMILES for (2,6-difluorophenyl)-[2-(2-hydroxycyclopentyl)pyrrolidin-1-yl]methanone is O=C(c1c(F)cccc1F)N1CCCC1C1CCCC1O.
What is the InChIKey of (2,6-difluorophenyl)-[2-(2-hydroxycyclopentyl)pyrrolidin-1-yl]methanone?
The InChIKey is WUBXUFXGXCWZRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19F2NO2/c17-11-5-2-6-12(18)15(11)16(21)19-9-3-7-13(19)10-4-1-8-14(10)20/h2,5-6,10,13-14,20H,1,3-4,7-9H2.
What are the key properties of (2,6-difluorophenyl)-[2-(2-hydroxycyclopentyl)pyrrolidin-1-yl]methanone?
(2,6-difluorophenyl)-[2-(2-hydroxycyclopentyl)pyrrolidin-1-yl]methanone has a molecular weight of 295.33 g/mol, XLogP of 2.73, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-difluorophenyl)-[2-(2-hydroxycyclopentyl)pyrrolidin-1-yl]methanone is sourced from PubChem (CID 79539009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).