2-(3-methoxyphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide

C20H25NO6 — CID 43910190

IUPAC2-(3-methoxyphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide
SMILESCOc1cccc(OC(C)C(=O)NCc2ccc(OC)c(OC)c2OC)c1
InChIInChI=1S/C20H25NO6/c1-13(27-16-8-6-7-15(11-16)23-2)20(22)21-12-14-9-10-17(24-3)19(26-5)18(14)25-4/h6-11,13H,12H2,1-5H3,(H,21,22)
InChIKeyZWUCYTSUTIRUCV-UHFFFAOYSA-N
MW375.42 g/mol
LogP2.80
Rot. Bonds9

About 2-(3-methoxyphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide

2-(3-methoxyphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide (PubChem CID 43910190) has the molecular formula C20H25NO6 and a molecular weight of 375.42 g/mol. Its IUPAC name is 2-(3-methoxyphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide.

Molecular Properties

Compound Name2-(3-methoxyphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide
PubChem CID43910190
Molecular FormulaC20H25NO6
Molecular Weight375.42 g/mol
Exact Mass375.17
IUPAC Name2-(3-methoxyphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide
SMILESCOc1cccc(OC(C)C(=O)NCc2ccc(OC)c(OC)c2OC)c1
InChIInChI=1S/C20H25NO6/c1-13(27-16-8-6-7-15(11-16)23-2)20(22)21-12-14-9-10-17(24-3)19(26-5)18(14)25-4/h6-11,13H,12H2,1-5H3,(H,21,22)
InChIKeyZWUCYTSUTIRUCV-UHFFFAOYSA-N
XLogP2.80
TPSA75.25 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.42
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(2S)-2-(4-methoxyphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide
CID 94049685
2-naphthalen-1-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide
CID 132660138
2-(2-propan-2-ylphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide
CID 43876908
2-(2-chlorophenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide
CID 132656973
(2S)-2-(3-methoxyphenoxy)-N-propylpropanamide
CID 30392232
N-[(2,3,4-trimethoxyphenyl)methyl]acetamide
CID 18425632
N-(furan-2-ylmethyl)-2-(3-methoxyphenoxy)propanamide
CID 19203901
(2R)-N-[(4-fluorophenyl)methyl]-2-(3-methoxyphenoxy)propanamide
CID 92675443
(2R)-2-(3-chlorophenoxy)-N-[(3,4,5-trimethoxyphenyl)methyl]propanamide
CID 41261490
2-(3,4-dimethylphenoxy)-N-[(3-methoxyphenyl)methyl]propanamide
CID 53286233
(2S)-2-(3-methoxyphenoxy)-N-(3-methoxypropyl)propanamide
CID 92673516
2-(3-methylphenoxy)-N-(naphthalen-1-ylmethyl)propanamide
CID 133218956

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide?
The IUPAC name of 2-(3-methoxyphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide (CID 43910190) is 2-(3-methoxyphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide.
What is the SMILES notation for 2-(3-methoxyphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide?
The canonical SMILES for 2-(3-methoxyphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide is COc1cccc(OC(C)C(=O)NCc2ccc(OC)c(OC)c2OC)c1.
What is the InChIKey of 2-(3-methoxyphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide?
The InChIKey is ZWUCYTSUTIRUCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO6/c1-13(27-16-8-6-7-15(11-16)23-2)20(22)21-12-14-9-10-17(24-3)19(26-5)18(14)25-4/h6-11,13H,12H2,1-5H3,(H,21,22).
What are the key properties of 2-(3-methoxyphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide?
2-(3-methoxyphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide has a molecular weight of 375.42 g/mol, XLogP of 2.80, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide is sourced from PubChem (CID 43910190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).