2-(3-methoxyphenoxy)-N-[(3-methoxyphenyl)methyl]butanamide

C19H23NO4 — CID 53284474

IUPAC2-(3-methoxyphenoxy)-N-[(3-methoxyphenyl)methyl]butanamide
SMILESCCC(Oc1cccc(OC)c1)C(=O)NCc1cccc(OC)c1
InChIInChI=1S/C19H23NO4/c1-4-18(24-17-10-6-9-16(12-17)23-3)19(21)20-13-14-7-5-8-15(11-14)22-2/h5-12,18H,4,13H2,1-3H3,(H,20,21)
InChIKeySMQUAWGRLDJQDV-UHFFFAOYSA-N
MW329.40 g/mol
LogP3.18
Rot. Bonds8

About 2-(3-methoxyphenoxy)-N-[(3-methoxyphenyl)methyl]butanamide

2-(3-methoxyphenoxy)-N-[(3-methoxyphenyl)methyl]butanamide (PubChem CID 53284474) has the molecular formula C19H23NO4 and a molecular weight of 329.40 g/mol. Its IUPAC name is 2-(3-methoxyphenoxy)-N-[(3-methoxyphenyl)methyl]butanamide.

Molecular Properties

Compound Name2-(3-methoxyphenoxy)-N-[(3-methoxyphenyl)methyl]butanamide
PubChem CID53284474
Molecular FormulaC19H23NO4
Molecular Weight329.40 g/mol
Exact Mass329.16
IUPAC Name2-(3-methoxyphenoxy)-N-[(3-methoxyphenyl)methyl]butanamide
SMILESCCC(Oc1cccc(OC)c1)C(=O)NCc1cccc(OC)c1
InChIInChI=1S/C19H23NO4/c1-4-18(24-17-10-6-9-16(12-17)23-3)19(21)20-13-14-7-5-8-15(11-14)22-2/h5-12,18H,4,13H2,1-3H3,(H,20,21)
InChIKeySMQUAWGRLDJQDV-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-(3-methoxyphenoxy)-N-[(3-methoxyphenyl)methyl]butanamide?
The IUPAC name of 2-(3-methoxyphenoxy)-N-[(3-methoxyphenyl)methyl]butanamide (CID 53284474) is 2-(3-methoxyphenoxy)-N-[(3-methoxyphenyl)methyl]butanamide.
What is the SMILES notation for 2-(3-methoxyphenoxy)-N-[(3-methoxyphenyl)methyl]butanamide?
The canonical SMILES for 2-(3-methoxyphenoxy)-N-[(3-methoxyphenyl)methyl]butanamide is CCC(Oc1cccc(OC)c1)C(=O)NCc1cccc(OC)c1.
What is the InChIKey of 2-(3-methoxyphenoxy)-N-[(3-methoxyphenyl)methyl]butanamide?
The InChIKey is SMQUAWGRLDJQDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO4/c1-4-18(24-17-10-6-9-16(12-17)23-3)19(21)20-13-14-7-5-8-15(11-14)22-2/h5-12,18H,4,13H2,1-3H3,(H,20,21).
What are the key properties of 2-(3-methoxyphenoxy)-N-[(3-methoxyphenyl)methyl]butanamide?
2-(3-methoxyphenoxy)-N-[(3-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-(3-methoxyphenoxy)-N-[(3-methoxyphenyl)methyl]butanamide is sourced from PubChem (CID 53284474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).