N-(2-fluoro-3,5-dimethoxyphenyl)acetamide

C10H12FNO3 — CID 86705656

IUPACN-(2-fluoro-3,5-dimethoxyphenyl)acetamide
SMILESCOc1cc(NC(C)=O)c(F)c(OC)c1
InChIInChI=1S/C10H12FNO3/c1-6(13)12-8-4-7(14-2)5-9(15-3)10(8)11/h4-5H,1-3H3,(H,12,13)
InChIKeyDQOFFSULKOVMHY-UHFFFAOYSA-N
MW213.21 g/mol
LogP1.80
Rot. Bonds3

About N-(2-fluoro-3,5-dimethoxyphenyl)acetamide

N-(2-fluoro-3,5-dimethoxyphenyl)acetamide (PubChem CID 86705656) has the molecular formula C10H12FNO3 and a molecular weight of 213.21 g/mol. Its IUPAC name is N-(2-fluoro-3,5-dimethoxyphenyl)acetamide.

Molecular Properties

Compound NameN-(2-fluoro-3,5-dimethoxyphenyl)acetamide
PubChem CID86705656
Molecular FormulaC10H12FNO3
Molecular Weight213.21 g/mol
Exact Mass213.08
IUPAC NameN-(2-fluoro-3,5-dimethoxyphenyl)acetamide
SMILESCOc1cc(NC(C)=O)c(F)c(OC)c1
InChIInChI=1S/C10H12FNO3/c1-6(13)12-8-4-7(14-2)5-9(15-3)10(8)11/h4-5H,1-3H3,(H,12,13)
InChIKeyDQOFFSULKOVMHY-UHFFFAOYSA-N
XLogP1.80
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.21
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-3,5-dimethoxyphenyl)acetamide?
The IUPAC name of N-(2-fluoro-3,5-dimethoxyphenyl)acetamide (CID 86705656) is N-(2-fluoro-3,5-dimethoxyphenyl)acetamide.
What is the SMILES notation for N-(2-fluoro-3,5-dimethoxyphenyl)acetamide?
The canonical SMILES for N-(2-fluoro-3,5-dimethoxyphenyl)acetamide is COc1cc(NC(C)=O)c(F)c(OC)c1.
What is the InChIKey of N-(2-fluoro-3,5-dimethoxyphenyl)acetamide?
The InChIKey is DQOFFSULKOVMHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNO3/c1-6(13)12-8-4-7(14-2)5-9(15-3)10(8)11/h4-5H,1-3H3,(H,12,13).
What are the key properties of N-(2-fluoro-3,5-dimethoxyphenyl)acetamide?
N-(2-fluoro-3,5-dimethoxyphenyl)acetamide has a molecular weight of 213.21 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-3,5-dimethoxyphenyl)acetamide is sourced from PubChem (CID 86705656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).