N-(2-methoxyethyl)-2-[(3-methylbenzoyl)amino]benzamide

C18H20N2O3 — CID 2986700

IUPACN-(2-methoxyethyl)-2-[(3-methylbenzoyl)amino]benzamide
SMILESCOCCNC(=O)c1ccccc1NC(=O)c1cccc(C)c1
InChIInChI=1S/C18H20N2O3/c1-13-6-5-7-14(12-13)17(21)20-16-9-4-3-8-15(16)18(22)19-10-11-23-2/h3-9,12H,10-11H2,1-2H3,(H,19,22)(H,20,21)
InChIKeySKUQBWFSTBQXKI-UHFFFAOYSA-N
MW312.37 g/mol
LogP2.62
Rot. Bonds6

About N-(2-methoxyethyl)-2-[(3-methylbenzoyl)amino]benzamide

N-(2-methoxyethyl)-2-[(3-methylbenzoyl)amino]benzamide (PubChem CID 2986700) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-[(3-methylbenzoyl)amino]benzamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-[(3-methylbenzoyl)amino]benzamide
PubChem CID2986700
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC NameN-(2-methoxyethyl)-2-[(3-methylbenzoyl)amino]benzamide
SMILESCOCCNC(=O)c1ccccc1NC(=O)c1cccc(C)c1
InChIInChI=1S/C18H20N2O3/c1-13-6-5-7-14(12-13)17(21)20-16-9-4-3-8-15(16)18(22)19-10-11-23-2/h3-9,12H,10-11H2,1-2H3,(H,19,22)(H,20,21)
InChIKeySKUQBWFSTBQXKI-UHFFFAOYSA-N
XLogP2.62
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-[(3-methylbenzoyl)amino]benzamide?
The IUPAC name of N-(2-methoxyethyl)-2-[(3-methylbenzoyl)amino]benzamide (CID 2986700) is N-(2-methoxyethyl)-2-[(3-methylbenzoyl)amino]benzamide.
What is the SMILES notation for N-(2-methoxyethyl)-2-[(3-methylbenzoyl)amino]benzamide?
The canonical SMILES for N-(2-methoxyethyl)-2-[(3-methylbenzoyl)amino]benzamide is COCCNC(=O)c1ccccc1NC(=O)c1cccc(C)c1.
What is the InChIKey of N-(2-methoxyethyl)-2-[(3-methylbenzoyl)amino]benzamide?
The InChIKey is SKUQBWFSTBQXKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-13-6-5-7-14(12-13)17(21)20-16-9-4-3-8-15(16)18(22)19-10-11-23-2/h3-9,12H,10-11H2,1-2H3,(H,19,22)(H,20,21).
What are the key properties of N-(2-methoxyethyl)-2-[(3-methylbenzoyl)amino]benzamide?
N-(2-methoxyethyl)-2-[(3-methylbenzoyl)amino]benzamide has a molecular weight of 312.37 g/mol, XLogP of 2.62, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-[(3-methylbenzoyl)amino]benzamide is sourced from PubChem (CID 2986700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).