3-acetamido-N-(3-methoxyphenyl)-3-(4-methoxyphenyl)propanamide

C19H22N2O4 — CID 78805825

IUPAC3-acetamido-N-(3-methoxyphenyl)-3-(4-methoxyphenyl)propanamide
SMILESCOc1ccc(C(CC(=O)Nc2cccc(OC)c2)NC(C)=O)cc1
InChIInChI=1S/C19H22N2O4/c1-13(22)20-18(14-7-9-16(24-2)10-8-14)12-19(23)21-15-5-4-6-17(11-15)25-3/h4-11,18H,12H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyMDVNGCNWVIYHNX-UHFFFAOYSA-N
MW342.40 g/mol
LogP2.91
Rot. Bonds7

About 3-acetamido-N-(3-methoxyphenyl)-3-(4-methoxyphenyl)propanamide

3-acetamido-N-(3-methoxyphenyl)-3-(4-methoxyphenyl)propanamide (PubChem CID 78805825) has the molecular formula C19H22N2O4 and a molecular weight of 342.40 g/mol. Its IUPAC name is 3-acetamido-N-(3-methoxyphenyl)-3-(4-methoxyphenyl)propanamide.

Molecular Properties

Compound Name3-acetamido-N-(3-methoxyphenyl)-3-(4-methoxyphenyl)propanamide
PubChem CID78805825
Molecular FormulaC19H22N2O4
Molecular Weight342.40 g/mol
Exact Mass342.16
IUPAC Name3-acetamido-N-(3-methoxyphenyl)-3-(4-methoxyphenyl)propanamide
SMILESCOc1ccc(C(CC(=O)Nc2cccc(OC)c2)NC(C)=O)cc1
InChIInChI=1S/C19H22N2O4/c1-13(22)20-18(14-7-9-16(24-2)10-8-14)12-19(23)21-15-5-4-6-17(11-15)25-3/h4-11,18H,12H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyMDVNGCNWVIYHNX-UHFFFAOYSA-N
XLogP2.91
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-(3-methoxyphenyl)-3-(4-methoxyphenyl)propanamide?
The IUPAC name of 3-acetamido-N-(3-methoxyphenyl)-3-(4-methoxyphenyl)propanamide (CID 78805825) is 3-acetamido-N-(3-methoxyphenyl)-3-(4-methoxyphenyl)propanamide.
What is the SMILES notation for 3-acetamido-N-(3-methoxyphenyl)-3-(4-methoxyphenyl)propanamide?
The canonical SMILES for 3-acetamido-N-(3-methoxyphenyl)-3-(4-methoxyphenyl)propanamide is COc1ccc(C(CC(=O)Nc2cccc(OC)c2)NC(C)=O)cc1.
What is the InChIKey of 3-acetamido-N-(3-methoxyphenyl)-3-(4-methoxyphenyl)propanamide?
The InChIKey is MDVNGCNWVIYHNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4/c1-13(22)20-18(14-7-9-16(24-2)10-8-14)12-19(23)21-15-5-4-6-17(11-15)25-3/h4-11,18H,12H2,1-3H3,(H,20,22)(H,21,23).
What are the key properties of 3-acetamido-N-(3-methoxyphenyl)-3-(4-methoxyphenyl)propanamide?
3-acetamido-N-(3-methoxyphenyl)-3-(4-methoxyphenyl)propanamide has a molecular weight of 342.40 g/mol, XLogP of 2.91, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-(3-methoxyphenyl)-3-(4-methoxyphenyl)propanamide is sourced from PubChem (CID 78805825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).