N-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide

C10H11BrFNO2 — CID 66999894

IUPACN-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide
SMILESCC(=O)N(CCO)c1ccc(F)cc1Br
InChIInChI=1S/C10H11BrFNO2/c1-7(15)13(4-5-14)10-3-2-8(12)6-9(10)11/h2-3,6,14H,4-5H2,1H3
InChIKeyZRYXORSIYUHYGG-UHFFFAOYSA-N
MW276.11 g/mol
LogP1.93
Rot. Bonds3

About N-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide

N-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide (PubChem CID 66999894) has the molecular formula C10H11BrFNO2 and a molecular weight of 276.11 g/mol. Its IUPAC name is N-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide.

Molecular Properties

Compound NameN-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide
PubChem CID66999894
Molecular FormulaC10H11BrFNO2
Molecular Weight276.11 g/mol
Exact Mass275.00
IUPAC NameN-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide
SMILESCC(=O)N(CCO)c1ccc(F)cc1Br
InChIInChI=1S/C10H11BrFNO2/c1-7(15)13(4-5-14)10-3-2-8(12)6-9(10)11/h2-3,6,14H,4-5H2,1H3
InChIKeyZRYXORSIYUHYGG-UHFFFAOYSA-N
XLogP1.93
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.11
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide?
The IUPAC name of N-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide (CID 66999894) is N-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide.
What is the SMILES notation for N-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide?
The canonical SMILES for N-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide is CC(=O)N(CCO)c1ccc(F)cc1Br.
What is the InChIKey of N-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide?
The InChIKey is ZRYXORSIYUHYGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrFNO2/c1-7(15)13(4-5-14)10-3-2-8(12)6-9(10)11/h2-3,6,14H,4-5H2,1H3.
What are the key properties of N-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide?
N-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide has a molecular weight of 276.11 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide is sourced from PubChem (CID 66999894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).