N-[2-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]acetamide

C16H16FNO3 — CID 9017920

IUPACN-[2-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]acetamide
SMILESCOc1ccc(F)cc1COc1ccccc1NC(C)=O
InChIInChI=1S/C16H16FNO3/c1-11(19)18-14-5-3-4-6-16(14)21-10-12-9-13(17)7-8-15(12)20-2/h3-9H,10H2,1-2H3,(H,18,19)
InChIKeyYJLLILWWIWLJHP-UHFFFAOYSA-N
MW289.31 g/mol
LogP3.37
Rot. Bonds5

About N-[2-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]acetamide

N-[2-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]acetamide (PubChem CID 9017920) has the molecular formula C16H16FNO3 and a molecular weight of 289.31 g/mol. Its IUPAC name is N-[2-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]acetamide.

Molecular Properties

Compound NameN-[2-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]acetamide
PubChem CID9017920
Molecular FormulaC16H16FNO3
Molecular Weight289.31 g/mol
Exact Mass289.11
IUPAC NameN-[2-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]acetamide
SMILESCOc1ccc(F)cc1COc1ccccc1NC(C)=O
InChIInChI=1S/C16H16FNO3/c1-11(19)18-14-5-3-4-6-16(14)21-10-12-9-13(17)7-8-15(12)20-2/h3-9H,10H2,1-2H3,(H,18,19)
InChIKeyYJLLILWWIWLJHP-UHFFFAOYSA-N
XLogP3.37
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.31
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]acetamide?
The IUPAC name of N-[2-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]acetamide (CID 9017920) is N-[2-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]acetamide.
What is the SMILES notation for N-[2-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]acetamide?
The canonical SMILES for N-[2-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]acetamide is COc1ccc(F)cc1COc1ccccc1NC(C)=O.
What is the InChIKey of N-[2-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]acetamide?
The InChIKey is YJLLILWWIWLJHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNO3/c1-11(19)18-14-5-3-4-6-16(14)21-10-12-9-13(17)7-8-15(12)20-2/h3-9H,10H2,1-2H3,(H,18,19).
What are the key properties of N-[2-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]acetamide?
N-[2-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]acetamide has a molecular weight of 289.31 g/mol, XLogP of 3.37, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]acetamide is sourced from PubChem (CID 9017920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).