2-[2-(dimethylamino)anilino]-N-(2-fluorophenyl)acetamide

C16H18FN3O — CID 106759760

IUPAC2-[2-(dimethylamino)anilino]-N-(2-fluorophenyl)acetamide
SMILESCN(C)c1ccccc1NCC(=O)Nc1ccccc1F
InChIInChI=1S/C16H18FN3O/c1-20(2)15-10-6-5-9-14(15)18-11-16(21)19-13-8-4-3-7-12(13)17/h3-10,18H,11H2,1-2H3,(H,19,21)
InChIKeyNTUKISWXRFIARX-UHFFFAOYSA-N
MW287.34 g/mol
LogP2.94
Rot. Bonds5

About 2-[2-(dimethylamino)anilino]-N-(2-fluorophenyl)acetamide

2-[2-(dimethylamino)anilino]-N-(2-fluorophenyl)acetamide (PubChem CID 106759760) has the molecular formula C16H18FN3O and a molecular weight of 287.34 g/mol. Its IUPAC name is 2-[2-(dimethylamino)anilino]-N-(2-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-[2-(dimethylamino)anilino]-N-(2-fluorophenyl)acetamide
PubChem CID106759760
Molecular FormulaC16H18FN3O
Molecular Weight287.34 g/mol
Exact Mass287.14
IUPAC Name2-[2-(dimethylamino)anilino]-N-(2-fluorophenyl)acetamide
SMILESCN(C)c1ccccc1NCC(=O)Nc1ccccc1F
InChIInChI=1S/C16H18FN3O/c1-20(2)15-10-6-5-9-14(15)18-11-16(21)19-13-8-4-3-7-12(13)17/h3-10,18H,11H2,1-2H3,(H,19,21)
InChIKeyNTUKISWXRFIARX-UHFFFAOYSA-N
XLogP2.94
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(dimethylamino)anilino]-N-(3-fluorophenyl)acetamide
CID 106759867
2-(2-ethylanilino)-N-(2-fluorophenyl)acetamide
CID 9105155
2-(2,6-dimethylanilino)-N-(2-fluorophenyl)acetamide
CID 54818107
2-(3-chloro-2-methylanilino)-N-(2-fluorophenyl)acetamide
CID 9099260
N-(2-fluorophenyl)-2-[2-(methoxymethyl)anilino]acetamide
CID 61062982
2-[[2-(2-fluoroanilino)-2-oxoethyl]amino]-N,N-dimethylpropanamide
CID 61464633
2-[2-(dimethylamino)ethylamino]-N-(2-fluorophenyl)acetamide
CID 28586883
3-[[2-(2-fluoroanilino)-2-oxoethyl]amino]-2-methylbenzamide
CID 78866555
N-(3-chloro-2-methylphenyl)-2-(2-fluoroanilino)acetamide
CID 2604427
N-(2-fluorophenyl)-2-[(1-hydroxy-3-methylbutan-2-yl)amino]acetamide
CID 79248992
2-[(1,3-dimethylpyrazol-4-yl)amino]-N-(2-fluorophenyl)acetamide
CID 102805391
(2R)-2-[[2-(2-fluoroanilino)-2-oxoethyl]amino]propanoic acid
CID 83194252

Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)anilino]-N-(2-fluorophenyl)acetamide?
The IUPAC name of 2-[2-(dimethylamino)anilino]-N-(2-fluorophenyl)acetamide (CID 106759760) is 2-[2-(dimethylamino)anilino]-N-(2-fluorophenyl)acetamide.
What is the SMILES notation for 2-[2-(dimethylamino)anilino]-N-(2-fluorophenyl)acetamide?
The canonical SMILES for 2-[2-(dimethylamino)anilino]-N-(2-fluorophenyl)acetamide is CN(C)c1ccccc1NCC(=O)Nc1ccccc1F.
What is the InChIKey of 2-[2-(dimethylamino)anilino]-N-(2-fluorophenyl)acetamide?
The InChIKey is NTUKISWXRFIARX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FN3O/c1-20(2)15-10-6-5-9-14(15)18-11-16(21)19-13-8-4-3-7-12(13)17/h3-10,18H,11H2,1-2H3,(H,19,21).
What are the key properties of 2-[2-(dimethylamino)anilino]-N-(2-fluorophenyl)acetamide?
2-[2-(dimethylamino)anilino]-N-(2-fluorophenyl)acetamide has a molecular weight of 287.34 g/mol, XLogP of 2.94, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)anilino]-N-(2-fluorophenyl)acetamide is sourced from PubChem (CID 106759760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).