2-[3-[(3-methoxybenzoyl)amino]propanoylamino]benzamide

C18H19N3O4 — CID 17226172

IUPAC2-[3-[(3-methoxybenzoyl)amino]propanoylamino]benzamide
SMILESCOc1cccc(C(=O)NCCC(=O)Nc2ccccc2C(N)=O)c1
InChIInChI=1S/C18H19N3O4/c1-25-13-6-4-5-12(11-13)18(24)20-10-9-16(22)21-15-8-3-2-7-14(15)17(19)23/h2-8,11H,9-10H2,1H3,(H2,19,23)(H,20,24)(H,21,22)
InChIKeyOVKRZNSFHBRWRG-UHFFFAOYSA-N
MW341.37 g/mol
LogP1.55
Rot. Bonds7

About 2-[3-[(3-methoxybenzoyl)amino]propanoylamino]benzamide

2-[3-[(3-methoxybenzoyl)amino]propanoylamino]benzamide (PubChem CID 17226172) has the molecular formula C18H19N3O4 and a molecular weight of 341.37 g/mol. Its IUPAC name is 2-[3-[(3-methoxybenzoyl)amino]propanoylamino]benzamide.

Molecular Properties

Compound Name2-[3-[(3-methoxybenzoyl)amino]propanoylamino]benzamide
PubChem CID17226172
Molecular FormulaC18H19N3O4
Molecular Weight341.37 g/mol
Exact Mass341.14
IUPAC Name2-[3-[(3-methoxybenzoyl)amino]propanoylamino]benzamide
SMILESCOc1cccc(C(=O)NCCC(=O)Nc2ccccc2C(N)=O)c1
InChIInChI=1S/C18H19N3O4/c1-25-13-6-4-5-12(11-13)18(24)20-10-9-16(22)21-15-8-3-2-7-14(15)17(19)23/h2-8,11H,9-10H2,1H3,(H2,19,23)(H,20,24)(H,21,22)
InChIKeyOVKRZNSFHBRWRG-UHFFFAOYSA-N
XLogP1.55
TPSA110.52 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 51.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-butyl-2-[3-[(3-methoxybenzoyl)amino]propanoylamino]benzamide
CID 17226272
N-(3-ethoxypropyl)-2-[3-[(3-methoxybenzoyl)amino]propanoylamino]benzamide
CID 17226286
[2-(2-carbamoylanilino)-2-oxoethyl] 2-[(3-methoxybenzoyl)amino]acetate
CID 7899308
methyl 2-[3-[(3,5-dimethoxybenzoyl)amino]propanoylamino]benzoate
CID 17191696
N-[3-[2-[(3-methoxyphenyl)carbamoyl]anilino]-3-oxopropyl]naphthalene-2-carboxamide
CID 55577306
N-[3-(4-fluoroanilino)-3-oxopropyl]-3-methoxybenzamide
CID 17226080
3-methoxy-N-[3-oxo-3-(pyridin-4-ylamino)propyl]benzamide
CID 17226091
3-methoxy-N-[3-(3-methylanilino)-3-oxopropyl]benzamide
CID 17226085
3,5-dimethoxy-N-[3-(2-methoxyanilino)-3-oxopropyl]benzamide
CID 17191665
ethyl 3-[3-[(3-methoxybenzoyl)amino]propanoylamino]benzoate
CID 17226184
3-methoxy-N-[3-[(3-methoxybenzoyl)amino]propyl]benzamide
CID 2167030
2-chloro-N-[2-[(3-methoxybenzoyl)amino]ethyl]benzamide
CID 7354272

Frequently Asked Questions

What is the IUPAC name of 2-[3-[(3-methoxybenzoyl)amino]propanoylamino]benzamide?
The IUPAC name of 2-[3-[(3-methoxybenzoyl)amino]propanoylamino]benzamide (CID 17226172) is 2-[3-[(3-methoxybenzoyl)amino]propanoylamino]benzamide.
What is the SMILES notation for 2-[3-[(3-methoxybenzoyl)amino]propanoylamino]benzamide?
The canonical SMILES for 2-[3-[(3-methoxybenzoyl)amino]propanoylamino]benzamide is COc1cccc(C(=O)NCCC(=O)Nc2ccccc2C(N)=O)c1.
What is the InChIKey of 2-[3-[(3-methoxybenzoyl)amino]propanoylamino]benzamide?
The InChIKey is OVKRZNSFHBRWRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O4/c1-25-13-6-4-5-12(11-13)18(24)20-10-9-16(22)21-15-8-3-2-7-14(15)17(19)23/h2-8,11H,9-10H2,1H3,(H2,19,23)(H,20,24)(H,21,22).
What are the key properties of 2-[3-[(3-methoxybenzoyl)amino]propanoylamino]benzamide?
2-[3-[(3-methoxybenzoyl)amino]propanoylamino]benzamide has a molecular weight of 341.37 g/mol, XLogP of 1.55, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[(3-methoxybenzoyl)amino]propanoylamino]benzamide is sourced from PubChem (CID 17226172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).