N-(2-chlorophenyl)-2-(3,3-difluoroazetidin-1-yl)acetamide

C11H11ClF2N2O — CID 171701399

IUPACN-(2-chlorophenyl)-2-(3,3-difluoroazetidin-1-yl)acetamide
SMILESO=C(CN1CC(F)(F)C1)Nc1ccccc1Cl
InChIInChI=1S/C11H11ClF2N2O/c12-8-3-1-2-4-9(8)15-10(17)5-16-6-11(13,14)7-16/h1-4H,5-7H2,(H,15,17)
InChIKeyIFGGRBVTZZXVEY-UHFFFAOYSA-N
MW260.67 g/mol
LogP2.23
Rot. Bonds3

About N-(2-chlorophenyl)-2-(3,3-difluoroazetidin-1-yl)acetamide

N-(2-chlorophenyl)-2-(3,3-difluoroazetidin-1-yl)acetamide (PubChem CID 171701399) has the molecular formula C11H11ClF2N2O and a molecular weight of 260.67 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2-(3,3-difluoroazetidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2-(3,3-difluoroazetidin-1-yl)acetamide
PubChem CID171701399
Molecular FormulaC11H11ClF2N2O
Molecular Weight260.67 g/mol
Exact Mass260.05
IUPAC NameN-(2-chlorophenyl)-2-(3,3-difluoroazetidin-1-yl)acetamide
SMILESO=C(CN1CC(F)(F)C1)Nc1ccccc1Cl
InChIInChI=1S/C11H11ClF2N2O/c12-8-3-1-2-4-9(8)15-10(17)5-16-6-11(13,14)7-16/h1-4H,5-7H2,(H,15,17)
InChIKeyIFGGRBVTZZXVEY-UHFFFAOYSA-N
XLogP2.23
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.67
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-chlorophenyl)-2-pyrrolidin-1-ylacetamide;hydrochloride
CID 24832355
2-(azepan-1-yl)-N-(2-chlorophenyl)acetamide
CID 2070988
N-(2-chlorophenyl)-2-(4-methylpiperazin-1-yl)acetamide
CID 22197633
N-(2-chlorophenyl)-2-[4-(2-chlorophenyl)piperazin-1-yl]acetamide
CID 2608315
N-(2-chlorophenyl)-2-(4-prop-2-ynylpiperazin-1-yl)acetamide
CID 47109715
2-[4-[2-(2-chloroanilino)-2-oxoethyl]piperazin-1-yl]-N-(2-methylphenyl)acetamide
CID 29161450
2-[4-[2-[[(2R)-butan-2-yl]amino]-2-oxoethyl]piperazin-1-yl]-N-(2-chlorophenyl)acetamide
CID 9434323
N-(2-chlorophenyl)-2-[4-[2-oxo-2-(2,4,6-trichloroanilino)ethyl]piperazin-1-yl]acetamide
CID 29161558
N-(2-chlorophenyl)-2-(4-prop-2-enylpiperazin-1-yl)acetamide
CID 78795478
N-(2,5-dichlorophenyl)-2-(3,3-difluoropyrrolidin-1-yl)acetamide
CID 171701418
1-[2-(2-chloroanilino)-2-oxoethyl]-3-methylpiperidine-3-carboxylic acid
CID 63136943
N-(2-chlorophenyl)-2-(2,5-dioxopyrrolidin-1-yl)acetamide
CID 17034752

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2-(3,3-difluoroazetidin-1-yl)acetamide?
The IUPAC name of N-(2-chlorophenyl)-2-(3,3-difluoroazetidin-1-yl)acetamide (CID 171701399) is N-(2-chlorophenyl)-2-(3,3-difluoroazetidin-1-yl)acetamide.
What is the SMILES notation for N-(2-chlorophenyl)-2-(3,3-difluoroazetidin-1-yl)acetamide?
The canonical SMILES for N-(2-chlorophenyl)-2-(3,3-difluoroazetidin-1-yl)acetamide is O=C(CN1CC(F)(F)C1)Nc1ccccc1Cl.
What is the InChIKey of N-(2-chlorophenyl)-2-(3,3-difluoroazetidin-1-yl)acetamide?
The InChIKey is IFGGRBVTZZXVEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClF2N2O/c12-8-3-1-2-4-9(8)15-10(17)5-16-6-11(13,14)7-16/h1-4H,5-7H2,(H,15,17).
What are the key properties of N-(2-chlorophenyl)-2-(3,3-difluoroazetidin-1-yl)acetamide?
N-(2-chlorophenyl)-2-(3,3-difluoroazetidin-1-yl)acetamide has a molecular weight of 260.67 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-2-(3,3-difluoroazetidin-1-yl)acetamide is sourced from PubChem (CID 171701399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).