N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]acetamide

C17H19NO3 — CID 84590450

IUPACN-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]acetamide
SMILESCOc1cccc(COc2cccc(NC(C)=O)c2C)c1
InChIInChI=1S/C17H19NO3/c1-12-16(18-13(2)19)8-5-9-17(12)21-11-14-6-4-7-15(10-14)20-3/h4-10H,11H2,1-3H3,(H,18,19)
InChIKeyFBEOEECQHKBKHN-UHFFFAOYSA-N
MW285.34 g/mol
LogP3.54
Rot. Bonds5

About N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]acetamide

N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]acetamide (PubChem CID 84590450) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]acetamide.

Molecular Properties

Compound NameN-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]acetamide
PubChem CID84590450
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC NameN-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]acetamide
SMILESCOc1cccc(COc2cccc(NC(C)=O)c2C)c1
InChIInChI=1S/C17H19NO3/c1-12-16(18-13(2)19)8-5-9-17(12)21-11-14-6-4-7-15(10-14)20-3/h4-10H,11H2,1-3H3,(H,18,19)
InChIKeyFBEOEECQHKBKHN-UHFFFAOYSA-N
XLogP3.54
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]acetamide?
The IUPAC name of N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]acetamide (CID 84590450) is N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]acetamide.
What is the SMILES notation for N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]acetamide?
The canonical SMILES for N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]acetamide is COc1cccc(COc2cccc(NC(C)=O)c2C)c1.
What is the InChIKey of N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]acetamide?
The InChIKey is FBEOEECQHKBKHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c1-12-16(18-13(2)19)8-5-9-17(12)21-11-14-6-4-7-15(10-14)20-3/h4-10H,11H2,1-3H3,(H,18,19).
What are the key properties of N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]acetamide?
N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]acetamide has a molecular weight of 285.34 g/mol, XLogP of 3.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]acetamide is sourced from PubChem (CID 84590450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).