2-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-(4-phenoxyphenyl)benzamide

C27H21N3O3 — CID 18274448

IUPAC2-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-(4-phenoxyphenyl)benzamide
SMILESO=C(Nc1ccc(Oc2ccccc2)cc1)c1ccccc1OCc1cn2ccccc2n1
InChIInChI=1S/C27H21N3O3/c31-27(29-20-13-15-23(16-14-20)33-22-8-2-1-3-9-22)24-10-4-5-11-25(24)32-19-21-18-30-17-7-6-12-26(30)28-21/h1-18H,19H2,(H,29,31)
InChIKeyYIUBYLJWLUEREJ-UHFFFAOYSA-N
MW435.48 g/mol
LogP5.96
Rot. Bonds7

About 2-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-(4-phenoxyphenyl)benzamide

2-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-(4-phenoxyphenyl)benzamide (PubChem CID 18274448) has the molecular formula C27H21N3O3 and a molecular weight of 435.48 g/mol. Its IUPAC name is 2-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-(4-phenoxyphenyl)benzamide.

Molecular Properties

Compound Name2-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-(4-phenoxyphenyl)benzamide
PubChem CID18274448
Molecular FormulaC27H21N3O3
Molecular Weight435.48 g/mol
Exact Mass435.16
IUPAC Name2-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-(4-phenoxyphenyl)benzamide
SMILESO=C(Nc1ccc(Oc2ccccc2)cc1)c1ccccc1OCc1cn2ccccc2n1
InChIInChI=1S/C27H21N3O3/c31-27(29-20-13-15-23(16-14-20)33-22-8-2-1-3-9-22)24-10-4-5-11-25(24)32-19-21-18-30-17-7-6-12-26(30)28-21/h1-18H,19H2,(H,29,31)
InChIKeyYIUBYLJWLUEREJ-UHFFFAOYSA-N
XLogP5.96
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms33
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500435.48
LogP ≤ 55.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-(4-phenoxyphenyl)benzamide?
The IUPAC name of 2-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-(4-phenoxyphenyl)benzamide (CID 18274448) is 2-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-(4-phenoxyphenyl)benzamide.
What is the SMILES notation for 2-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-(4-phenoxyphenyl)benzamide?
The canonical SMILES for 2-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-(4-phenoxyphenyl)benzamide is O=C(Nc1ccc(Oc2ccccc2)cc1)c1ccccc1OCc1cn2ccccc2n1.
What is the InChIKey of 2-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-(4-phenoxyphenyl)benzamide?
The InChIKey is YIUBYLJWLUEREJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H21N3O3/c31-27(29-20-13-15-23(16-14-20)33-22-8-2-1-3-9-22)24-10-4-5-11-25(24)32-19-21-18-30-17-7-6-12-26(30)28-21/h1-18H,19H2,(H,29,31).
What are the key properties of 2-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-(4-phenoxyphenyl)benzamide?
2-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-(4-phenoxyphenyl)benzamide has a molecular weight of 435.48 g/mol, XLogP of 5.96, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-(4-phenoxyphenyl)benzamide is sourced from PubChem (CID 18274448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).