N-[2-(dimethylamino)-2-oxoethyl]-2,4-difluorobenzamide

C11H12F2N2O2 — CID 9480520

IUPACN-[2-(dimethylamino)-2-oxoethyl]-2,4-difluorobenzamide
SMILESCN(C)C(=O)CNC(=O)c1ccc(F)cc1F
InChIInChI=1S/C11H12F2N2O2/c1-15(2)10(16)6-14-11(17)8-4-3-7(12)5-9(8)13/h3-5H,6H2,1-2H3,(H,14,17)
InChIKeyFCISPLZOGDEHNV-UHFFFAOYSA-N
MW242.22 g/mol
LogP0.78
Rot. Bonds3

About N-[2-(dimethylamino)-2-oxoethyl]-2,4-difluorobenzamide

N-[2-(dimethylamino)-2-oxoethyl]-2,4-difluorobenzamide (PubChem CID 9480520) has the molecular formula C11H12F2N2O2 and a molecular weight of 242.22 g/mol. Its IUPAC name is N-[2-(dimethylamino)-2-oxoethyl]-2,4-difluorobenzamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-2-oxoethyl]-2,4-difluorobenzamide
PubChem CID9480520
Molecular FormulaC11H12F2N2O2
Molecular Weight242.22 g/mol
Exact Mass242.09
IUPAC NameN-[2-(dimethylamino)-2-oxoethyl]-2,4-difluorobenzamide
SMILESCN(C)C(=O)CNC(=O)c1ccc(F)cc1F
InChIInChI=1S/C11H12F2N2O2/c1-15(2)10(16)6-14-11(17)8-4-3-7(12)5-9(8)13/h3-5H,6H2,1-2H3,(H,14,17)
InChIKeyFCISPLZOGDEHNV-UHFFFAOYSA-N
XLogP0.78
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.22
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[2-(dimethylamino)-2-oxoethyl]-2,4-difluorobenzamide 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

2,4-difluoro-N-[2-[(2-fluorophenyl)methyl-methylamino]-2-oxoethyl]benzamide
CID 51192378
2,4-difluoro-N-(2-methylprop-2-enyl)benzamide
CID 114618824
N-[2-[[4-(dimethylcarbamoyl)phenyl]methyl-ethylamino]-2-oxoethyl]-2,4-difluorobenzamide
CID 56510929
2-[[2-[(2,4-difluorobenzoyl)amino]acetyl]-propan-2-ylamino]acetic acid
CID 139013505
2,4-difluoro-N-(3-methyl-2-oxobutyl)benzamide
CID 64996923
N-[2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl]-2,4-difluorobenzamide
CID 38107976
N-[2-[benzyl-[2-(dimethylamino)ethyl]amino]-2-oxoethyl]-2,4-difluorobenzamide
CID 78838061
N-[2-[cyanomethyl(propyl)amino]-2-oxoethyl]-2,4-difluorobenzamide
CID 86796409
N-[3-(dimethylamino)-2-hydroxypropyl]-2,4-difluorobenzamide
CID 110281414
N-[2-[cyclopropyl-[(4-fluorophenyl)methyl]amino]-2-oxoethyl]-2,4-difluorobenzamide
CID 29304745
2,4-difluoro-N-[2-[3-[methyl(methylsulfonyl)amino]propylamino]-2-oxoethyl]benzamide
CID 46434276
2-[[2-(dimethylamino)-2-oxoethyl]carbamoylamino]-4-fluorobenzoic acid
CID 61199325

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-2-oxoethyl]-2,4-difluorobenzamide?
The IUPAC name of N-[2-(dimethylamino)-2-oxoethyl]-2,4-difluorobenzamide (CID 9480520) is N-[2-(dimethylamino)-2-oxoethyl]-2,4-difluorobenzamide.
What is the SMILES notation for N-[2-(dimethylamino)-2-oxoethyl]-2,4-difluorobenzamide?
The canonical SMILES for N-[2-(dimethylamino)-2-oxoethyl]-2,4-difluorobenzamide is CN(C)C(=O)CNC(=O)c1ccc(F)cc1F.
What is the InChIKey of N-[2-(dimethylamino)-2-oxoethyl]-2,4-difluorobenzamide?
The InChIKey is FCISPLZOGDEHNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12F2N2O2/c1-15(2)10(16)6-14-11(17)8-4-3-7(12)5-9(8)13/h3-5H,6H2,1-2H3,(H,14,17).
What are the key properties of N-[2-(dimethylamino)-2-oxoethyl]-2,4-difluorobenzamide?
N-[2-(dimethylamino)-2-oxoethyl]-2,4-difluorobenzamide has a molecular weight of 242.22 g/mol, XLogP of 0.78, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-2-oxoethyl]-2,4-difluorobenzamide is sourced from PubChem (CID 9480520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).