(2,4-difluorophenyl)-(4-hydroxy-2,2-dimethylpiperidin-1-yl)methanone

C14H17F2NO2 — CID 115275985

IUPAC(2,4-difluorophenyl)-(4-hydroxy-2,2-dimethylpiperidin-1-yl)methanone
SMILESCC1(C)CC(O)CCN1C(=O)c1ccc(F)cc1F
InChIInChI=1S/C14H17F2NO2/c1-14(2)8-10(18)5-6-17(14)13(19)11-4-3-9(15)7-12(11)16/h3-4,7,10,18H,5-6,8H2,1-2H3
InChIKeyVWEYQNMRDSFVOZ-UHFFFAOYSA-N
MW269.29 g/mol
LogP2.34
Rot. Bonds1

About (2,4-difluorophenyl)-(4-hydroxy-2,2-dimethylpiperidin-1-yl)methanone

(2,4-difluorophenyl)-(4-hydroxy-2,2-dimethylpiperidin-1-yl)methanone (PubChem CID 115275985) has the molecular formula C14H17F2NO2 and a molecular weight of 269.29 g/mol. Its IUPAC name is (2,4-difluorophenyl)-(4-hydroxy-2,2-dimethylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(2,4-difluorophenyl)-(4-hydroxy-2,2-dimethylpiperidin-1-yl)methanone
PubChem CID115275985
Molecular FormulaC14H17F2NO2
Molecular Weight269.29 g/mol
Exact Mass269.12
IUPAC Name(2,4-difluorophenyl)-(4-hydroxy-2,2-dimethylpiperidin-1-yl)methanone
SMILESCC1(C)CC(O)CCN1C(=O)c1ccc(F)cc1F
InChIInChI=1S/C14H17F2NO2/c1-14(2)8-10(18)5-6-17(14)13(19)11-4-3-9(15)7-12(11)16/h3-4,7,10,18H,5-6,8H2,1-2H3
InChIKeyVWEYQNMRDSFVOZ-UHFFFAOYSA-N
XLogP2.34
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.29
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2,4-difluorophenyl)-(4-hydroxy-2,2-dimethylpiperidin-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

(4-amino-2,2-dimethylpiperidin-1-yl)-(2,4-difluorophenyl)methanone
CID 115276129
(3-amino-2,2-dimethylpyrrolidin-1-yl)-(2,4-difluorophenyl)methanone
CID 115275243
(4-amino-2,2-dimethylpiperidin-1-yl)-(2,5-difluorophenyl)methanone
CID 115276128
[5-[2-(2,5-difluorophenyl)ethynyl]pyrimidin-2-yl]-(4-hydroxy-2,2-dimethylpiperidin-1-yl)methanone
CID 70896637
(4-amino-3,3-dimethylpiperidin-1-yl)-(2,4-difluorophenyl)methanone
CID 115276649
(2,4-difluorophenyl)-(4-methylpiperidin-1-yl)methanone
CID 588075
(2,4-difluorophenyl)-[(3R)-3-hydroxypiperidin-1-yl]methanone
CID 68625081
(3-amino-2,2-dimethylpyrrolidin-1-yl)-(2,5-difluorophenyl)methanone
CID 115275242
(5-bromopyrimidin-2-yl)-(4-hydroxy-2,2-dimethylpiperidin-1-yl)methanone
CID 70896633
(2,4-difluorophenyl)-[(2R)-2-methylpiperidin-1-yl]methanone
CID 2347956
(2,2-dimethylpyrrolidin-1-yl)-(4-fluoro-2-methylphenyl)methanone
CID 112702642
(2,4-difluorophenyl)-(4-methylsulfonylpiperidin-1-yl)methanone
CID 90585099

Frequently Asked Questions

What is the IUPAC name of (2,4-difluorophenyl)-(4-hydroxy-2,2-dimethylpiperidin-1-yl)methanone?
The IUPAC name of (2,4-difluorophenyl)-(4-hydroxy-2,2-dimethylpiperidin-1-yl)methanone (CID 115275985) is (2,4-difluorophenyl)-(4-hydroxy-2,2-dimethylpiperidin-1-yl)methanone.
What is the SMILES notation for (2,4-difluorophenyl)-(4-hydroxy-2,2-dimethylpiperidin-1-yl)methanone?
The canonical SMILES for (2,4-difluorophenyl)-(4-hydroxy-2,2-dimethylpiperidin-1-yl)methanone is CC1(C)CC(O)CCN1C(=O)c1ccc(F)cc1F.
What is the InChIKey of (2,4-difluorophenyl)-(4-hydroxy-2,2-dimethylpiperidin-1-yl)methanone?
The InChIKey is VWEYQNMRDSFVOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17F2NO2/c1-14(2)8-10(18)5-6-17(14)13(19)11-4-3-9(15)7-12(11)16/h3-4,7,10,18H,5-6,8H2,1-2H3.
What are the key properties of (2,4-difluorophenyl)-(4-hydroxy-2,2-dimethylpiperidin-1-yl)methanone?
(2,4-difluorophenyl)-(4-hydroxy-2,2-dimethylpiperidin-1-yl)methanone has a molecular weight of 269.29 g/mol, XLogP of 2.34, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-difluorophenyl)-(4-hydroxy-2,2-dimethylpiperidin-1-yl)methanone is sourced from PubChem (CID 115275985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).