N-[4-chloro-3-(difluoromethoxy)phenyl]-2-(2-oxopiperidin-1-yl)acetamide

C14H15ClF2N2O3 — CID 122136418

IUPACN-[4-chloro-3-(difluoromethoxy)phenyl]-2-(2-oxopiperidin-1-yl)acetamide
SMILESO=C(CN1CCCCC1=O)Nc1ccc(Cl)c(OC(F)F)c1
InChIInChI=1S/C14H15ClF2N2O3/c15-10-5-4-9(7-11(10)22-14(16)17)18-12(20)8-19-6-2-1-3-13(19)21/h4-5,7,14H,1-3,6,8H2,(H,18,20)
InChIKeyAEWUVEJXZOXTJD-UHFFFAOYSA-N
MW332.73 g/mol
LogP2.89
Rot. Bonds5

About N-[4-chloro-3-(difluoromethoxy)phenyl]-2-(2-oxopiperidin-1-yl)acetamide

N-[4-chloro-3-(difluoromethoxy)phenyl]-2-(2-oxopiperidin-1-yl)acetamide (PubChem CID 122136418) has the molecular formula C14H15ClF2N2O3 and a molecular weight of 332.73 g/mol. Its IUPAC name is N-[4-chloro-3-(difluoromethoxy)phenyl]-2-(2-oxopiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-[4-chloro-3-(difluoromethoxy)phenyl]-2-(2-oxopiperidin-1-yl)acetamide
PubChem CID122136418
Molecular FormulaC14H15ClF2N2O3
Molecular Weight332.73 g/mol
Exact Mass332.07
IUPAC NameN-[4-chloro-3-(difluoromethoxy)phenyl]-2-(2-oxopiperidin-1-yl)acetamide
SMILESO=C(CN1CCCCC1=O)Nc1ccc(Cl)c(OC(F)F)c1
InChIInChI=1S/C14H15ClF2N2O3/c15-10-5-4-9(7-11(10)22-14(16)17)18-12(20)8-19-6-2-1-3-13(19)21/h4-5,7,14H,1-3,6,8H2,(H,18,20)
InChIKeyAEWUVEJXZOXTJD-UHFFFAOYSA-N
XLogP2.89
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.73
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[4-chloro-3-(difluoromethoxy)phenyl]-2-(2-oxopiperidin-1-yl)acetamide 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 N-[4-chloro-3-(difluoromethoxy)phenyl]-2-(2-oxopiperidin-1-yl)acetamide?
The IUPAC name of N-[4-chloro-3-(difluoromethoxy)phenyl]-2-(2-oxopiperidin-1-yl)acetamide (CID 122136418) is N-[4-chloro-3-(difluoromethoxy)phenyl]-2-(2-oxopiperidin-1-yl)acetamide.
What is the SMILES notation for N-[4-chloro-3-(difluoromethoxy)phenyl]-2-(2-oxopiperidin-1-yl)acetamide?
The canonical SMILES for N-[4-chloro-3-(difluoromethoxy)phenyl]-2-(2-oxopiperidin-1-yl)acetamide is O=C(CN1CCCCC1=O)Nc1ccc(Cl)c(OC(F)F)c1.
What is the InChIKey of N-[4-chloro-3-(difluoromethoxy)phenyl]-2-(2-oxopiperidin-1-yl)acetamide?
The InChIKey is AEWUVEJXZOXTJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClF2N2O3/c15-10-5-4-9(7-11(10)22-14(16)17)18-12(20)8-19-6-2-1-3-13(19)21/h4-5,7,14H,1-3,6,8H2,(H,18,20).
What are the key properties of N-[4-chloro-3-(difluoromethoxy)phenyl]-2-(2-oxopiperidin-1-yl)acetamide?
N-[4-chloro-3-(difluoromethoxy)phenyl]-2-(2-oxopiperidin-1-yl)acetamide has a molecular weight of 332.73 g/mol, XLogP of 2.89, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-chloro-3-(difluoromethoxy)phenyl]-2-(2-oxopiperidin-1-yl)acetamide is sourced from PubChem (CID 122136418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).