N-(2-chloro-4-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide

C16H16ClNO4 — CID 110777937

IUPACN-(2-chloro-4-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccc(NC(=O)COc2ccccc2OC)c(Cl)c1
InChIInChI=1S/C16H16ClNO4/c1-20-11-7-8-13(12(17)9-11)18-16(19)10-22-15-6-4-3-5-14(15)21-2/h3-9H,10H2,1-2H3,(H,18,19)
InChIKeyGJOHSWCIOHLTIG-UHFFFAOYSA-N
MW321.76 g/mol
LogP3.37
Rot. Bonds6

About N-(2-chloro-4-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide

N-(2-chloro-4-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide (PubChem CID 110777937) has the molecular formula C16H16ClNO4 and a molecular weight of 321.76 g/mol. Its IUPAC name is N-(2-chloro-4-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-(2-chloro-4-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide
PubChem CID110777937
Molecular FormulaC16H16ClNO4
Molecular Weight321.76 g/mol
Exact Mass321.08
IUPAC NameN-(2-chloro-4-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccc(NC(=O)COc2ccccc2OC)c(Cl)c1
InChIInChI=1S/C16H16ClNO4/c1-20-11-7-8-13(12(17)9-11)18-16(19)10-22-15-6-4-3-5-14(15)21-2/h3-9H,10H2,1-2H3,(H,18,19)
InChIKeyGJOHSWCIOHLTIG-UHFFFAOYSA-N
XLogP3.37
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.76
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide?
The IUPAC name of N-(2-chloro-4-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide (CID 110777937) is N-(2-chloro-4-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide.
What is the SMILES notation for N-(2-chloro-4-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide?
The canonical SMILES for N-(2-chloro-4-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide is COc1ccc(NC(=O)COc2ccccc2OC)c(Cl)c1.
What is the InChIKey of N-(2-chloro-4-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide?
The InChIKey is GJOHSWCIOHLTIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClNO4/c1-20-11-7-8-13(12(17)9-11)18-16(19)10-22-15-6-4-3-5-14(15)21-2/h3-9H,10H2,1-2H3,(H,18,19).
What are the key properties of N-(2-chloro-4-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide?
N-(2-chloro-4-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide has a molecular weight of 321.76 g/mol, XLogP of 3.37, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide is sourced from PubChem (CID 110777937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).