2-(2-methoxyphenoxy)-N-[(4-methoxyphenyl)methyl]butanamide

C19H23NO4 — CID 53286217

IUPAC2-(2-methoxyphenoxy)-N-[(4-methoxyphenyl)methyl]butanamide
SMILESCCC(Oc1ccccc1OC)C(=O)NCc1ccc(OC)cc1
InChIInChI=1S/C19H23NO4/c1-4-16(24-18-8-6-5-7-17(18)23-3)19(21)20-13-14-9-11-15(22-2)12-10-14/h5-12,16H,4,13H2,1-3H3,(H,20,21)
InChIKeyMTVOTMWJEBFKIM-UHFFFAOYSA-N
MW329.40 g/mol
LogP3.18
Rot. Bonds8

About 2-(2-methoxyphenoxy)-N-[(4-methoxyphenyl)methyl]butanamide

2-(2-methoxyphenoxy)-N-[(4-methoxyphenyl)methyl]butanamide (PubChem CID 53286217) has the molecular formula C19H23NO4 and a molecular weight of 329.40 g/mol. Its IUPAC name is 2-(2-methoxyphenoxy)-N-[(4-methoxyphenyl)methyl]butanamide.

Molecular Properties

Compound Name2-(2-methoxyphenoxy)-N-[(4-methoxyphenyl)methyl]butanamide
PubChem CID53286217
Molecular FormulaC19H23NO4
Molecular Weight329.40 g/mol
Exact Mass329.16
IUPAC Name2-(2-methoxyphenoxy)-N-[(4-methoxyphenyl)methyl]butanamide
SMILESCCC(Oc1ccccc1OC)C(=O)NCc1ccc(OC)cc1
InChIInChI=1S/C19H23NO4/c1-4-16(24-18-8-6-5-7-17(18)23-3)19(21)20-13-14-9-11-15(22-2)12-10-14/h5-12,16H,4,13H2,1-3H3,(H,20,21)
InChIKeyMTVOTMWJEBFKIM-UHFFFAOYSA-N
XLogP3.18
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenoxy)-N-[(4-methoxyphenyl)methyl]butanamide?
The IUPAC name of 2-(2-methoxyphenoxy)-N-[(4-methoxyphenyl)methyl]butanamide (CID 53286217) is 2-(2-methoxyphenoxy)-N-[(4-methoxyphenyl)methyl]butanamide.
What is the SMILES notation for 2-(2-methoxyphenoxy)-N-[(4-methoxyphenyl)methyl]butanamide?
The canonical SMILES for 2-(2-methoxyphenoxy)-N-[(4-methoxyphenyl)methyl]butanamide is CCC(Oc1ccccc1OC)C(=O)NCc1ccc(OC)cc1.
What is the InChIKey of 2-(2-methoxyphenoxy)-N-[(4-methoxyphenyl)methyl]butanamide?
The InChIKey is MTVOTMWJEBFKIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO4/c1-4-16(24-18-8-6-5-7-17(18)23-3)19(21)20-13-14-9-11-15(22-2)12-10-14/h5-12,16H,4,13H2,1-3H3,(H,20,21).
What are the key properties of 2-(2-methoxyphenoxy)-N-[(4-methoxyphenyl)methyl]butanamide?
2-(2-methoxyphenoxy)-N-[(4-methoxyphenyl)methyl]butanamide has a molecular weight of 329.40 g/mol, XLogP of 3.18, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenoxy)-N-[(4-methoxyphenyl)methyl]butanamide is sourced from PubChem (CID 53286217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).