4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide

C19H23NO5 — CID 15943272

IUPAC4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide
SMILESCOCCOc1ccc(NC(=O)c2ccc(OCCOC)cc2)cc1
InChIInChI=1S/C19H23NO5/c1-22-11-13-24-17-7-3-15(4-8-17)19(21)20-16-5-9-18(10-6-16)25-14-12-23-2/h3-10H,11-14H2,1-2H3,(H,20,21)
InChIKeyTVRFTXAEDVWXJG-UHFFFAOYSA-N
MW345.40 g/mol
LogP2.99
Rot. Bonds10

About 4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide

4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide (PubChem CID 15943272) has the molecular formula C19H23NO5 and a molecular weight of 345.40 g/mol. Its IUPAC name is 4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide.

Molecular Properties

Compound Name4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide
PubChem CID15943272
Molecular FormulaC19H23NO5
Molecular Weight345.40 g/mol
Exact Mass345.16
IUPAC Name4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide
SMILESCOCCOc1ccc(NC(=O)c2ccc(OCCOC)cc2)cc1
InChIInChI=1S/C19H23NO5/c1-22-11-13-24-17-7-3-15(4-8-17)19(21)20-16-5-9-18(10-6-16)25-14-12-23-2/h3-10H,11-14H2,1-2H3,(H,20,21)
InChIKeyTVRFTXAEDVWXJG-UHFFFAOYSA-N
XLogP2.99
TPSA66.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide?
The IUPAC name of 4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide (CID 15943272) is 4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide.
What is the SMILES notation for 4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide?
The canonical SMILES for 4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide is COCCOc1ccc(NC(=O)c2ccc(OCCOC)cc2)cc1.
What is the InChIKey of 4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide?
The InChIKey is TVRFTXAEDVWXJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO5/c1-22-11-13-24-17-7-3-15(4-8-17)19(21)20-16-5-9-18(10-6-16)25-14-12-23-2/h3-10H,11-14H2,1-2H3,(H,20,21).
What are the key properties of 4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide?
4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide has a molecular weight of 345.40 g/mol, XLogP of 2.99, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide is sourced from PubChem (CID 15943272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).