2-[3-(4-chlorophenyl)-5-methoxyphenyl]acetamide

C15H14ClNO2 — CID 3046237

IUPAC2-[3-(4-chlorophenyl)-5-methoxyphenyl]acetamide
SMILESCOc1cc(CC(N)=O)cc(-c2ccc(Cl)cc2)c1
InChIInChI=1S/C15H14ClNO2/c1-19-14-7-10(8-15(17)18)6-12(9-14)11-2-4-13(16)5-3-11/h2-7,9H,8H2,1H3,(H2,17,18)
InChIKeyJVGHXODMGADGTJ-UHFFFAOYSA-N
MW275.74 g/mol
LogP3.04
Rot. Bonds4

About 2-[3-(4-chlorophenyl)-5-methoxyphenyl]acetamide

2-[3-(4-chlorophenyl)-5-methoxyphenyl]acetamide (PubChem CID 3046237) has the molecular formula C15H14ClNO2 and a molecular weight of 275.74 g/mol. Its IUPAC name is 2-[3-(4-chlorophenyl)-5-methoxyphenyl]acetamide.

Molecular Properties

Compound Name2-[3-(4-chlorophenyl)-5-methoxyphenyl]acetamide
PubChem CID3046237
Molecular FormulaC15H14ClNO2
Molecular Weight275.74 g/mol
Exact Mass275.07
IUPAC Name2-[3-(4-chlorophenyl)-5-methoxyphenyl]acetamide
SMILESCOc1cc(CC(N)=O)cc(-c2ccc(Cl)cc2)c1
InChIInChI=1S/C15H14ClNO2/c1-19-14-7-10(8-15(17)18)6-12(9-14)11-2-4-13(16)5-3-11/h2-7,9H,8H2,1H3,(H2,17,18)
InChIKeyJVGHXODMGADGTJ-UHFFFAOYSA-N
XLogP3.04
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.74
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(4-chlorophenyl)-5-methoxyphenyl]acetamide?
The IUPAC name of 2-[3-(4-chlorophenyl)-5-methoxyphenyl]acetamide (CID 3046237) is 2-[3-(4-chlorophenyl)-5-methoxyphenyl]acetamide.
What is the SMILES notation for 2-[3-(4-chlorophenyl)-5-methoxyphenyl]acetamide?
The canonical SMILES for 2-[3-(4-chlorophenyl)-5-methoxyphenyl]acetamide is COc1cc(CC(N)=O)cc(-c2ccc(Cl)cc2)c1.
What is the InChIKey of 2-[3-(4-chlorophenyl)-5-methoxyphenyl]acetamide?
The InChIKey is JVGHXODMGADGTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO2/c1-19-14-7-10(8-15(17)18)6-12(9-14)11-2-4-13(16)5-3-11/h2-7,9H,8H2,1H3,(H2,17,18).
What are the key properties of 2-[3-(4-chlorophenyl)-5-methoxyphenyl]acetamide?
2-[3-(4-chlorophenyl)-5-methoxyphenyl]acetamide has a molecular weight of 275.74 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(4-chlorophenyl)-5-methoxyphenyl]acetamide is sourced from PubChem (CID 3046237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).