4-ethoxy-N-[2-[(4-ethoxybenzoyl)amino]ethyl]benzamide

C20H24N2O4 — CID 2164977

IUPAC4-ethoxy-N-[2-[(4-ethoxybenzoyl)amino]ethyl]benzamide
SMILESCCOc1ccc(C(=O)NCCNC(=O)c2ccc(OCC)cc2)cc1
InChIInChI=1S/C20H24N2O4/c1-3-25-17-9-5-15(6-10-17)19(23)21-13-14-22-20(24)16-7-11-18(12-8-16)26-4-2/h5-12H,3-4,13-14H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyYIOJAWKCPDDYBO-UHFFFAOYSA-N
MW356.42 g/mol
LogP2.64
Rot. Bonds9

About 4-ethoxy-N-[2-[(4-ethoxybenzoyl)amino]ethyl]benzamide

4-ethoxy-N-[2-[(4-ethoxybenzoyl)amino]ethyl]benzamide (PubChem CID 2164977) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is 4-ethoxy-N-[2-[(4-ethoxybenzoyl)amino]ethyl]benzamide.

Molecular Properties

Compound Name4-ethoxy-N-[2-[(4-ethoxybenzoyl)amino]ethyl]benzamide
PubChem CID2164977
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC Name4-ethoxy-N-[2-[(4-ethoxybenzoyl)amino]ethyl]benzamide
SMILESCCOc1ccc(C(=O)NCCNC(=O)c2ccc(OCC)cc2)cc1
InChIInChI=1S/C20H24N2O4/c1-3-25-17-9-5-15(6-10-17)19(23)21-13-14-22-20(24)16-7-11-18(12-8-16)26-4-2/h5-12H,3-4,13-14H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyYIOJAWKCPDDYBO-UHFFFAOYSA-N
XLogP2.64
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 52.64
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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Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-[2-[(4-ethoxybenzoyl)amino]ethyl]benzamide?
The IUPAC name of 4-ethoxy-N-[2-[(4-ethoxybenzoyl)amino]ethyl]benzamide (CID 2164977) is 4-ethoxy-N-[2-[(4-ethoxybenzoyl)amino]ethyl]benzamide.
What is the SMILES notation for 4-ethoxy-N-[2-[(4-ethoxybenzoyl)amino]ethyl]benzamide?
The canonical SMILES for 4-ethoxy-N-[2-[(4-ethoxybenzoyl)amino]ethyl]benzamide is CCOc1ccc(C(=O)NCCNC(=O)c2ccc(OCC)cc2)cc1.
What is the InChIKey of 4-ethoxy-N-[2-[(4-ethoxybenzoyl)amino]ethyl]benzamide?
The InChIKey is YIOJAWKCPDDYBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-3-25-17-9-5-15(6-10-17)19(23)21-13-14-22-20(24)16-7-11-18(12-8-16)26-4-2/h5-12H,3-4,13-14H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of 4-ethoxy-N-[2-[(4-ethoxybenzoyl)amino]ethyl]benzamide?
4-ethoxy-N-[2-[(4-ethoxybenzoyl)amino]ethyl]benzamide has a molecular weight of 356.42 g/mol, XLogP of 2.64, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-[2-[(4-ethoxybenzoyl)amino]ethyl]benzamide is sourced from PubChem (CID 2164977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).