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

C10H11BrFNO2 — CID 66999893

IUPAC2-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide
SMILESO=C(Cc1ccc(F)cc1Br)NCCO
InChIInChI=1S/C10H11BrFNO2/c11-9-6-8(12)2-1-7(9)5-10(15)13-3-4-14/h1-2,6,14H,3-5H2,(H,13,15)
InChIKeyGUMAKILFYANVAU-UHFFFAOYSA-N
MW276.11 g/mol
LogP1.24
Rot. Bonds4

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

2-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide (PubChem CID 66999893) has the molecular formula C10H11BrFNO2 and a molecular weight of 276.11 g/mol. Its IUPAC name is 2-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide.

Molecular Properties

Compound Name2-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide
PubChem CID66999893
Molecular FormulaC10H11BrFNO2
Molecular Weight276.11 g/mol
Exact Mass275.00
IUPAC Name2-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide
SMILESO=C(Cc1ccc(F)cc1Br)NCCO
InChIInChI=1S/C10H11BrFNO2/c11-9-6-8(12)2-1-7(9)5-10(15)13-3-4-14/h1-2,6,14H,3-5H2,(H,13,15)
InChIKeyGUMAKILFYANVAU-UHFFFAOYSA-N
XLogP1.24
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.11
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide?
The IUPAC name of 2-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide (CID 66999893) is 2-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide.
What is the SMILES notation for 2-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide?
The canonical SMILES for 2-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide is O=C(Cc1ccc(F)cc1Br)NCCO.
What is the InChIKey of 2-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide?
The InChIKey is GUMAKILFYANVAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrFNO2/c11-9-6-8(12)2-1-7(9)5-10(15)13-3-4-14/h1-2,6,14H,3-5H2,(H,13,15).
What are the key properties of 2-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide?
2-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide has a molecular weight of 276.11 g/mol, XLogP of 1.24, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromo-4-fluorophenyl)-N-(2-hydroxyethyl)acetamide is sourced from PubChem (CID 66999893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).