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

C19H22N2O4 — CID 2167030

IUPAC3-methoxy-N-[3-[(3-methoxybenzoyl)amino]propyl]benzamide
SMILESCOc1cccc(C(=O)NCCCNC(=O)c2cccc(OC)c2)c1
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
LogP2.25
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
SMILESCOc1cccc(C(=O)NCCCNC(=O)c2cccc(OC)c2)c1
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
XLogP2.25
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 52.25
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

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CID 114008510
3-methoxy-N-tridecylbenzamide
CID 139819898
N-[3-(dimethylamino)propyl]-3-methoxybenzamide
CID 3117661
3-methoxy-N-[3-(3-methylphenoxy)propyl]benzamide
CID 24533352
N-[2-[(3-methoxybenzoyl)amino]ethyl]-3,4-dimethylbenzamide
CID 108539237
3-ethoxy-N-[3-[(3-ethoxybenzoyl)amino]propyl]benzamide
CID 4958099
3-methoxy-N-[3-(4-nitroanilino)propyl]benzamide
CID 585373
3-methoxy-N-[2-[(2-phenylacetyl)amino]ethyl]benzamide
CID 40718391
3-methoxy-N-[2-[[4-(3-methoxyphenyl)benzoyl]amino]ethyl]benzamide
CID 134802561
3-methoxy-N-[2-[(4-phenylbenzoyl)amino]ethyl]benzamide
CID 40718395
N-[2-(methanesulfonamido)ethyl]-3-methoxybenzamide
CID 40718415
3-methoxy-N-[2-[[N-(3-methoxypropyl)-N'-methylcarbamimidoyl]amino]ethyl]benzamide;hydroiodide
CID 110974306

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 COc1cccc(C(=O)NCCCNC(=O)c2cccc(OC)c2)c1.
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 2.25, 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).