3-methoxy-N-[3-[(3-methoxybenzoyl)amino]propyl]benzamide

C19H22N2O4 — CID 2167030

IUPAC3-methoxy-N-[3-[(3-methoxybenzoyl)amino]propyl]benzamide
SMILESCOC1=CC=CC(=C1)C(=O)NCCCNC(=O)C2=CC(=CC=C2)OC
InChIInChI=1S/C19H22N2O4/c1-24-16-8-3-6-14(12-16)18(22)20-10-5-11-21-19(23)15-7-4-9-17(13-15)25-2/h3-4,6-9,12-13H,5,10-11H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyFXMJVYGLFKDQBR-UHFFFAOYSA-N
MW342.40 g/mol
LogP2.50
Rot. Bonds8

About 3-methoxy-N-[3-[(3-methoxybenzoyl)amino]propyl]benzamide

3-methoxy-N-[3-[(3-methoxybenzoyl)amino]propyl]benzamide (PubChem CID 2167030) has the molecular formula C19H22N2O4 and a molecular weight of 342.40 g/mol. Its IUPAC name is 3-methoxy-N-[3-[(3-methoxybenzoyl)amino]propyl]benzamide.

Molecular Properties

Compound Name3-methoxy-N-[3-[(3-methoxybenzoyl)amino]propyl]benzamide
PubChem CID2167030
Molecular FormulaC19H22N2O4
Molecular Weight342.40 g/mol
Exact Mass342.16
IUPAC Name3-methoxy-N-[3-[(3-methoxybenzoyl)amino]propyl]benzamide
SMILESCOC1=CC=CC(=C1)C(=O)NCCCNC(=O)C2=CC(=CC=C2)OC
InChIInChI=1S/C19H22N2O4/c1-24-16-8-3-6-14(12-16)18(22)20-10-5-11-21-19(23)15-7-4-9-17(13-15)25-2/h3-4,6-9,12-13H,5,10-11H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyFXMJVYGLFKDQBR-UHFFFAOYSA-N
XLogP2.50
TPSA76.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity392

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

Itopride
CID 3792
3-Methoxybenzamide
CID 98487
Itopride Hydrochloride
CID 129791
Snc 80
CID 123924
N-(3-Methoxybenzyl)Palmitamide
CID 71765531
(9Z,12Z)-N-(3-Methoxybenzyl)Octadeca-9,12-Dienamide
CID 73346043
PF-429242
CID 23661637
N-((4-(4-methoxyphenyl)tetrahydro-2H-pyran-4-yl)methyl)benzamide
CID 746156
N-benzyl-2-(4-methoxyphenyl)acetamide
CID 795936
4-methoxy-N-(2-oxo-2-phenylethyl)benzamide
CID 796649
N-[3-(dimethylamino)propyl]-2-phenoxybenzamide
CID 1928169
N-(4-methoxyphenethyl)benzamide
CID 3083797

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[3-[(3-methoxybenzoyl)amino]propyl]benzamide?
The IUPAC name of 3-methoxy-N-[3-[(3-methoxybenzoyl)amino]propyl]benzamide (CID 2167030) is 3-methoxy-N-[3-[(3-methoxybenzoyl)amino]propyl]benzamide.
What is the SMILES notation for 3-methoxy-N-[3-[(3-methoxybenzoyl)amino]propyl]benzamide?
The canonical SMILES for 3-methoxy-N-[3-[(3-methoxybenzoyl)amino]propyl]benzamide is COC1=CC=CC(=C1)C(=O)NCCCNC(=O)C2=CC(=CC=C2)OC.
What is the InChIKey of 3-methoxy-N-[3-[(3-methoxybenzoyl)amino]propyl]benzamide?
The InChIKey is FXMJVYGLFKDQBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4/c1-24-16-8-3-6-14(12-16)18(22)20-10-5-11-21-19(23)15-7-4-9-17(13-15)25-2/h3-4,6-9,12-13H,5,10-11H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of 3-methoxy-N-[3-[(3-methoxybenzoyl)amino]propyl]benzamide?
3-methoxy-N-[3-[(3-methoxybenzoyl)amino]propyl]benzamide has a molecular weight of 342.40 g/mol, XLogP of 2.50, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[3-[(3-methoxybenzoyl)amino]propyl]benzamide is sourced from PubChem (CID 2167030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).