2-(5-chloro-2-fluorophenyl)-N-(2-hydroxyethyl)acetamide

C10H11ClFNO2 — CID 82475017

IUPAC2-(5-chloro-2-fluorophenyl)-N-(2-hydroxyethyl)acetamide
SMILESO=C(Cc1cc(Cl)ccc1F)NCCO
InChIInChI=1S/C10H11ClFNO2/c11-8-1-2-9(12)7(5-8)6-10(15)13-3-4-14/h1-2,5,14H,3-4,6H2,(H,13,15)
InChIKeyLORAMCUSAWTGRE-UHFFFAOYSA-N
MW231.65 g/mol
LogP1.13
Rot. Bonds4

About 2-(5-chloro-2-fluorophenyl)-N-(2-hydroxyethyl)acetamide

2-(5-chloro-2-fluorophenyl)-N-(2-hydroxyethyl)acetamide (PubChem CID 82475017) has the molecular formula C10H11ClFNO2 and a molecular weight of 231.65 g/mol. Its IUPAC name is 2-(5-chloro-2-fluorophenyl)-N-(2-hydroxyethyl)acetamide.

Molecular Properties

Compound Name2-(5-chloro-2-fluorophenyl)-N-(2-hydroxyethyl)acetamide
PubChem CID82475017
Molecular FormulaC10H11ClFNO2
Molecular Weight231.65 g/mol
Exact Mass231.05
IUPAC Name2-(5-chloro-2-fluorophenyl)-N-(2-hydroxyethyl)acetamide
SMILESO=C(Cc1cc(Cl)ccc1F)NCCO
InChIInChI=1S/C10H11ClFNO2/c11-8-1-2-9(12)7(5-8)6-10(15)13-3-4-14/h1-2,5,14H,3-4,6H2,(H,13,15)
InChIKeyLORAMCUSAWTGRE-UHFFFAOYSA-N
XLogP1.13
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.65
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2-fluorophenyl)-N-(2-hydroxyethyl)acetamide?
The IUPAC name of 2-(5-chloro-2-fluorophenyl)-N-(2-hydroxyethyl)acetamide (CID 82475017) is 2-(5-chloro-2-fluorophenyl)-N-(2-hydroxyethyl)acetamide.
What is the SMILES notation for 2-(5-chloro-2-fluorophenyl)-N-(2-hydroxyethyl)acetamide?
The canonical SMILES for 2-(5-chloro-2-fluorophenyl)-N-(2-hydroxyethyl)acetamide is O=C(Cc1cc(Cl)ccc1F)NCCO.
What is the InChIKey of 2-(5-chloro-2-fluorophenyl)-N-(2-hydroxyethyl)acetamide?
The InChIKey is LORAMCUSAWTGRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClFNO2/c11-8-1-2-9(12)7(5-8)6-10(15)13-3-4-14/h1-2,5,14H,3-4,6H2,(H,13,15).
What are the key properties of 2-(5-chloro-2-fluorophenyl)-N-(2-hydroxyethyl)acetamide?
2-(5-chloro-2-fluorophenyl)-N-(2-hydroxyethyl)acetamide has a molecular weight of 231.65 g/mol, XLogP of 1.13, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2-fluorophenyl)-N-(2-hydroxyethyl)acetamide is sourced from PubChem (CID 82475017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).