N-[2-(2-chloro-6-fluorophenyl)ethyl]-2-(2-hydroxyphenyl)acetamide

C16H15ClFNO2 — CID 71917928

IUPACN-[2-(2-chloro-6-fluorophenyl)ethyl]-2-(2-hydroxyphenyl)acetamide
SMILESO=C(Cc1ccccc1O)NCCc1c(F)cccc1Cl
InChIInChI=1S/C16H15ClFNO2/c17-13-5-3-6-14(18)12(13)8-9-19-16(21)10-11-4-1-2-7-15(11)20/h1-7,20H,8-10H2,(H,19,21)
InChIKeyLUXCZXHLYKIEOW-UHFFFAOYSA-N
MW307.75 g/mol
LogP3.09
Rot. Bonds5

About N-[2-(2-chloro-6-fluorophenyl)ethyl]-2-(2-hydroxyphenyl)acetamide

N-[2-(2-chloro-6-fluorophenyl)ethyl]-2-(2-hydroxyphenyl)acetamide (PubChem CID 71917928) has the molecular formula C16H15ClFNO2 and a molecular weight of 307.75 g/mol. Its IUPAC name is N-[2-(2-chloro-6-fluorophenyl)ethyl]-2-(2-hydroxyphenyl)acetamide.

Molecular Properties

Compound NameN-[2-(2-chloro-6-fluorophenyl)ethyl]-2-(2-hydroxyphenyl)acetamide
PubChem CID71917928
Molecular FormulaC16H15ClFNO2
Molecular Weight307.75 g/mol
Exact Mass307.08
IUPAC NameN-[2-(2-chloro-6-fluorophenyl)ethyl]-2-(2-hydroxyphenyl)acetamide
SMILESO=C(Cc1ccccc1O)NCCc1c(F)cccc1Cl
InChIInChI=1S/C16H15ClFNO2/c17-13-5-3-6-14(18)12(13)8-9-19-16(21)10-11-4-1-2-7-15(11)20/h1-7,20H,8-10H2,(H,19,21)
InChIKeyLUXCZXHLYKIEOW-UHFFFAOYSA-N
XLogP3.09
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.75
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-chloro-6-fluorophenyl)ethyl]-2-(2-hydroxyphenyl)acetamide?
The IUPAC name of N-[2-(2-chloro-6-fluorophenyl)ethyl]-2-(2-hydroxyphenyl)acetamide (CID 71917928) is N-[2-(2-chloro-6-fluorophenyl)ethyl]-2-(2-hydroxyphenyl)acetamide.
What is the SMILES notation for N-[2-(2-chloro-6-fluorophenyl)ethyl]-2-(2-hydroxyphenyl)acetamide?
The canonical SMILES for N-[2-(2-chloro-6-fluorophenyl)ethyl]-2-(2-hydroxyphenyl)acetamide is O=C(Cc1ccccc1O)NCCc1c(F)cccc1Cl.
What is the InChIKey of N-[2-(2-chloro-6-fluorophenyl)ethyl]-2-(2-hydroxyphenyl)acetamide?
The InChIKey is LUXCZXHLYKIEOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClFNO2/c17-13-5-3-6-14(18)12(13)8-9-19-16(21)10-11-4-1-2-7-15(11)20/h1-7,20H,8-10H2,(H,19,21).
What are the key properties of N-[2-(2-chloro-6-fluorophenyl)ethyl]-2-(2-hydroxyphenyl)acetamide?
N-[2-(2-chloro-6-fluorophenyl)ethyl]-2-(2-hydroxyphenyl)acetamide has a molecular weight of 307.75 g/mol, XLogP of 3.09, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-chloro-6-fluorophenyl)ethyl]-2-(2-hydroxyphenyl)acetamide is sourced from PubChem (CID 71917928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).