2-(2,2-difluoroethylamino)-N-(4-fluorophenyl)acetamide

C10H11F3N2O — CID 115406808

IUPAC2-(2,2-difluoroethylamino)-N-(4-fluorophenyl)acetamide
SMILESO=C(CNCC(F)F)Nc1ccc(F)cc1
InChIInChI=1S/C10H11F3N2O/c11-7-1-3-8(4-2-7)15-10(16)6-14-5-9(12)13/h1-4,9,14H,5-6H2,(H,15,16)
InChIKeyQVWLKKWKTOHSOO-UHFFFAOYSA-N
MW232.21 g/mol
LogP1.62
Rot. Bonds5

About 2-(2,2-difluoroethylamino)-N-(4-fluorophenyl)acetamide

2-(2,2-difluoroethylamino)-N-(4-fluorophenyl)acetamide (PubChem CID 115406808) has the molecular formula C10H11F3N2O and a molecular weight of 232.21 g/mol. Its IUPAC name is 2-(2,2-difluoroethylamino)-N-(4-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(2,2-difluoroethylamino)-N-(4-fluorophenyl)acetamide
PubChem CID115406808
Molecular FormulaC10H11F3N2O
Molecular Weight232.21 g/mol
Exact Mass232.08
IUPAC Name2-(2,2-difluoroethylamino)-N-(4-fluorophenyl)acetamide
SMILESO=C(CNCC(F)F)Nc1ccc(F)cc1
InChIInChI=1S/C10H11F3N2O/c11-7-1-3-8(4-2-7)15-10(16)6-14-5-9(12)13/h1-4,9,14H,5-6H2,(H,15,16)
InChIKeyQVWLKKWKTOHSOO-UHFFFAOYSA-N
XLogP1.62
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.21
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-fluorophenyl)-2-(2-hydroxypropylamino)acetamide
CID 43389711
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N-(4-fluorophenyl)-2-(propylamino)acetamide
CID 28586343
N-(4-fluorophenyl)-2-(prop-2-ynylamino)acetamide
CID 28563124
N-(4-fluorophenyl)-2-(pentylamino)acetamide
CID 28569105
2-[(4-fluorophenyl)methylamino]-N-(4-propan-2-ylphenyl)acetamide
CID 108997765
N-(4-fluorophenyl)-2-[2-[methyl(propan-2-yl)amino]ethylamino]acetamide
CID 62642513
N-(4-fluorophenyl)-2-(pyridin-4-ylmethylamino)acetamide
CID 17066841
N-(4-fluorophenyl)-2-(octylamino)acetamide
CID 78914389
N-(4-fluorophenyl)-2-(pyridazin-3-ylmethylamino)acetamide
CID 106895590
2-[[(2S)-butan-2-yl]amino]-N-(4-fluorophenyl)acetamide
CID 28565900
N-[2-(4-fluoroanilino)-2-oxoethyl]-3-methylbutanamide
CID 5205104

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-difluoroethylamino)-N-(4-fluorophenyl)acetamide?
The IUPAC name of 2-(2,2-difluoroethylamino)-N-(4-fluorophenyl)acetamide (CID 115406808) is 2-(2,2-difluoroethylamino)-N-(4-fluorophenyl)acetamide.
What is the SMILES notation for 2-(2,2-difluoroethylamino)-N-(4-fluorophenyl)acetamide?
The canonical SMILES for 2-(2,2-difluoroethylamino)-N-(4-fluorophenyl)acetamide is O=C(CNCC(F)F)Nc1ccc(F)cc1.
What is the InChIKey of 2-(2,2-difluoroethylamino)-N-(4-fluorophenyl)acetamide?
The InChIKey is QVWLKKWKTOHSOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3N2O/c11-7-1-3-8(4-2-7)15-10(16)6-14-5-9(12)13/h1-4,9,14H,5-6H2,(H,15,16).
What are the key properties of 2-(2,2-difluoroethylamino)-N-(4-fluorophenyl)acetamide?
2-(2,2-difluoroethylamino)-N-(4-fluorophenyl)acetamide has a molecular weight of 232.21 g/mol, XLogP of 1.62, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-difluoroethylamino)-N-(4-fluorophenyl)acetamide is sourced from PubChem (CID 115406808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).