2-(2-ethoxyethoxy)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide

C25H25N3O4 — CID 56582400

IUPAC2-(2-ethoxyethoxy)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide
SMILESCCOCCOc1ccccc1C(=O)Nc1cccc(OCc2cn3ccccc3n2)c1
InChIInChI=1S/C25H25N3O4/c1-2-30-14-15-31-23-11-4-3-10-22(23)25(29)27-19-8-7-9-21(16-19)32-18-20-17-28-13-6-5-12-24(28)26-20/h3-13,16-17H,2,14-15,18H2,1H3,(H,27,29)
InChIKeyYEFYHNLQXCMLKA-UHFFFAOYSA-N
MW431.49 g/mol
LogP4.58
Rot. Bonds10

About 2-(2-ethoxyethoxy)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide

2-(2-ethoxyethoxy)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide (PubChem CID 56582400) has the molecular formula C25H25N3O4 and a molecular weight of 431.49 g/mol. Its IUPAC name is 2-(2-ethoxyethoxy)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide.

Molecular Properties

Compound Name2-(2-ethoxyethoxy)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide
PubChem CID56582400
Molecular FormulaC25H25N3O4
Molecular Weight431.49 g/mol
Exact Mass431.18
IUPAC Name2-(2-ethoxyethoxy)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide
SMILESCCOCCOc1ccccc1C(=O)Nc1cccc(OCc2cn3ccccc3n2)c1
InChIInChI=1S/C25H25N3O4/c1-2-30-14-15-31-23-11-4-3-10-22(23)25(29)27-19-8-7-9-21(16-19)32-18-20-17-28-13-6-5-12-24(28)26-20/h3-13,16-17H,2,14-15,18H2,1H3,(H,27,29)
InChIKeyYEFYHNLQXCMLKA-UHFFFAOYSA-N
XLogP4.58
TPSA74.09 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms32
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.49
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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 2-(2-ethoxyethoxy)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide?
The IUPAC name of 2-(2-ethoxyethoxy)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide (CID 56582400) is 2-(2-ethoxyethoxy)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide.
What is the SMILES notation for 2-(2-ethoxyethoxy)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide?
The canonical SMILES for 2-(2-ethoxyethoxy)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide is CCOCCOc1ccccc1C(=O)Nc1cccc(OCc2cn3ccccc3n2)c1.
What is the InChIKey of 2-(2-ethoxyethoxy)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide?
The InChIKey is YEFYHNLQXCMLKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N3O4/c1-2-30-14-15-31-23-11-4-3-10-22(23)25(29)27-19-8-7-9-21(16-19)32-18-20-17-28-13-6-5-12-24(28)26-20/h3-13,16-17H,2,14-15,18H2,1H3,(H,27,29).
What are the key properties of 2-(2-ethoxyethoxy)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide?
2-(2-ethoxyethoxy)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide has a molecular weight of 431.49 g/mol, XLogP of 4.58, 10 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyethoxy)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide is sourced from PubChem (CID 56582400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).