2-(2,5-difluorophenyl)-N-[2-(dimethylamino)ethyl]acetamide

C12H16F2N2O — CID 141306049

IUPAC2-(2,5-difluorophenyl)-N-[2-(dimethylamino)ethyl]acetamide
SMILESCN(C)CCNC(=O)Cc1cc(F)ccc1F
InChIInChI=1S/C12H16F2N2O/c1-16(2)6-5-15-12(17)8-9-7-10(13)3-4-11(9)14/h3-4,7H,5-6,8H2,1-2H3,(H,15,17)
InChIKeyXWTBJYIRPIHNDE-UHFFFAOYSA-N
MW242.27 g/mol
LogP1.19
Rot. Bonds5

About 2-(2,5-difluorophenyl)-N-[2-(dimethylamino)ethyl]acetamide

2-(2,5-difluorophenyl)-N-[2-(dimethylamino)ethyl]acetamide (PubChem CID 141306049) has the molecular formula C12H16F2N2O and a molecular weight of 242.27 g/mol. Its IUPAC name is 2-(2,5-difluorophenyl)-N-[2-(dimethylamino)ethyl]acetamide.

Molecular Properties

Compound Name2-(2,5-difluorophenyl)-N-[2-(dimethylamino)ethyl]acetamide
PubChem CID141306049
Molecular FormulaC12H16F2N2O
Molecular Weight242.27 g/mol
Exact Mass242.12
IUPAC Name2-(2,5-difluorophenyl)-N-[2-(dimethylamino)ethyl]acetamide
SMILESCN(C)CCNC(=O)Cc1cc(F)ccc1F
InChIInChI=1S/C12H16F2N2O/c1-16(2)6-5-15-12(17)8-9-7-10(13)3-4-11(9)14/h3-4,7H,5-6,8H2,1-2H3,(H,15,17)
InChIKeyXWTBJYIRPIHNDE-UHFFFAOYSA-N
XLogP1.19
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.27
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(dimethylamino)ethyl]-2-(6-fluoro-1H-indol-3-yl)acetamide
CID 113209367
2-(4-chloro-2-methylphenyl)-N-[2-(dimethylamino)ethyl]acetamide
CID 67968231
N-[2-(2,5-difluorophenyl)ethyl]-2-(2-fluorophenyl)acetamide
CID 110788190
N-(2-amino-2-methylpropyl)-2-(2,5-difluorophenyl)acetamide;hydrochloride
CID 119627760
N-[2-(2,5-difluorophenyl)ethyl]propanamide
CID 71113752
N-[2-(2,5-difluorophenyl)ethyl]-2-(4-fluorophenyl)acetamide
CID 110788175
2-chloro-N-[2-(dimethylamino)ethyl]-4-fluorobenzamide
CID 6465941
2-[(2,5-difluorophenyl)methylamino]-N-(3-methoxypropyl)acetamide
CID 55234926
2-(2,5-difluorophenyl)-N-[2-(methylamino)propyl]acetamide;hydrochloride
CID 120831286
N-[2-(dimethylamino)ethyl]-2-[2-methoxy-5-(methylamino)phenyl]acetamide
CID 10730419
N-[(2,5-difluorophenyl)methyl]-3-oxobutanamide
CID 63795355
N-[[1-(aminomethyl)cyclopropyl]methyl]-2-(2,5-difluorophenyl)acetamide
CID 115271338

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-difluorophenyl)-N-[2-(dimethylamino)ethyl]acetamide?
The IUPAC name of 2-(2,5-difluorophenyl)-N-[2-(dimethylamino)ethyl]acetamide (CID 141306049) is 2-(2,5-difluorophenyl)-N-[2-(dimethylamino)ethyl]acetamide.
What is the SMILES notation for 2-(2,5-difluorophenyl)-N-[2-(dimethylamino)ethyl]acetamide?
The canonical SMILES for 2-(2,5-difluorophenyl)-N-[2-(dimethylamino)ethyl]acetamide is CN(C)CCNC(=O)Cc1cc(F)ccc1F.
What is the InChIKey of 2-(2,5-difluorophenyl)-N-[2-(dimethylamino)ethyl]acetamide?
The InChIKey is XWTBJYIRPIHNDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16F2N2O/c1-16(2)6-5-15-12(17)8-9-7-10(13)3-4-11(9)14/h3-4,7H,5-6,8H2,1-2H3,(H,15,17).
What are the key properties of 2-(2,5-difluorophenyl)-N-[2-(dimethylamino)ethyl]acetamide?
2-(2,5-difluorophenyl)-N-[2-(dimethylamino)ethyl]acetamide has a molecular weight of 242.27 g/mol, XLogP of 1.19, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-difluorophenyl)-N-[2-(dimethylamino)ethyl]acetamide is sourced from PubChem (CID 141306049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).