N-[3-[acetyl(methyl)amino]phenyl]-2-(2-methoxyphenoxy)acetamide

C18H20N2O4 — CID 46761828

IUPACN-[3-[acetyl(methyl)amino]phenyl]-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccccc1OCC(=O)Nc1cccc(N(C)C(C)=O)c1
InChIInChI=1S/C18H20N2O4/c1-13(21)20(2)15-8-6-7-14(11-15)19-18(22)12-24-17-10-5-4-9-16(17)23-3/h4-11H,12H2,1-3H3,(H,19,22)
InChIKeyMPTWQLNUWLBNLB-UHFFFAOYSA-N
MW328.37 g/mol
LogP2.70
Rot. Bonds6

About N-[3-[acetyl(methyl)amino]phenyl]-2-(2-methoxyphenoxy)acetamide

N-[3-[acetyl(methyl)amino]phenyl]-2-(2-methoxyphenoxy)acetamide (PubChem CID 46761828) has the molecular formula C18H20N2O4 and a molecular weight of 328.37 g/mol. Its IUPAC name is N-[3-[acetyl(methyl)amino]phenyl]-2-(2-methoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-[3-[acetyl(methyl)amino]phenyl]-2-(2-methoxyphenoxy)acetamide
PubChem CID46761828
Molecular FormulaC18H20N2O4
Molecular Weight328.37 g/mol
Exact Mass328.14
IUPAC NameN-[3-[acetyl(methyl)amino]phenyl]-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccccc1OCC(=O)Nc1cccc(N(C)C(C)=O)c1
InChIInChI=1S/C18H20N2O4/c1-13(21)20(2)15-8-6-7-14(11-15)19-18(22)12-24-17-10-5-4-9-16(17)23-3/h4-11H,12H2,1-3H3,(H,19,22)
InChIKeyMPTWQLNUWLBNLB-UHFFFAOYSA-N
XLogP2.70
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[3-[acetyl(methyl)amino]phenyl]-2-(2-methoxyphenoxy)acetamide?
The IUPAC name of N-[3-[acetyl(methyl)amino]phenyl]-2-(2-methoxyphenoxy)acetamide (CID 46761828) is N-[3-[acetyl(methyl)amino]phenyl]-2-(2-methoxyphenoxy)acetamide.
What is the SMILES notation for N-[3-[acetyl(methyl)amino]phenyl]-2-(2-methoxyphenoxy)acetamide?
The canonical SMILES for N-[3-[acetyl(methyl)amino]phenyl]-2-(2-methoxyphenoxy)acetamide is COc1ccccc1OCC(=O)Nc1cccc(N(C)C(C)=O)c1.
What is the InChIKey of N-[3-[acetyl(methyl)amino]phenyl]-2-(2-methoxyphenoxy)acetamide?
The InChIKey is MPTWQLNUWLBNLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O4/c1-13(21)20(2)15-8-6-7-14(11-15)19-18(22)12-24-17-10-5-4-9-16(17)23-3/h4-11H,12H2,1-3H3,(H,19,22).
What are the key properties of N-[3-[acetyl(methyl)amino]phenyl]-2-(2-methoxyphenoxy)acetamide?
N-[3-[acetyl(methyl)amino]phenyl]-2-(2-methoxyphenoxy)acetamide has a molecular weight of 328.37 g/mol, XLogP of 2.70, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[acetyl(methyl)amino]phenyl]-2-(2-methoxyphenoxy)acetamide is sourced from PubChem (CID 46761828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).