N-(2,5-diethoxyphenyl)-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide

C26H27N3O4 — CID 24617344

IUPACN-(2,5-diethoxyphenyl)-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
SMILESCCOc1ccc(OCC)c(NC(=O)c2ccc(OCc3cn4cc(C)ccc4n3)cc2)c1
InChIInChI=1S/C26H27N3O4/c1-4-31-22-11-12-24(32-5-2)23(14-22)28-26(30)19-7-9-21(10-8-19)33-17-20-16-29-15-18(3)6-13-25(29)27-20/h6-16H,4-5,17H2,1-3H3,(H,28,30)
InChIKeyVQCURPZNJLQISU-UHFFFAOYSA-N
MW445.52 g/mol
LogP5.27
Rot. Bonds9

About N-(2,5-diethoxyphenyl)-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide

N-(2,5-diethoxyphenyl)-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide (PubChem CID 24617344) has the molecular formula C26H27N3O4 and a molecular weight of 445.52 g/mol. Its IUPAC name is N-(2,5-diethoxyphenyl)-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide.

Molecular Properties

Compound NameN-(2,5-diethoxyphenyl)-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
PubChem CID24617344
Molecular FormulaC26H27N3O4
Molecular Weight445.52 g/mol
Exact Mass445.20
IUPAC NameN-(2,5-diethoxyphenyl)-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
SMILESCCOc1ccc(OCC)c(NC(=O)c2ccc(OCc3cn4cc(C)ccc4n3)cc2)c1
InChIInChI=1S/C26H27N3O4/c1-4-31-22-11-12-24(32-5-2)23(14-22)28-26(30)19-7-9-21(10-8-19)33-17-20-16-29-15-18(3)6-13-25(29)27-20/h6-16H,4-5,17H2,1-3H3,(H,28,30)
InChIKeyVQCURPZNJLQISU-UHFFFAOYSA-N
XLogP5.27
TPSA74.09 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms33
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500445.52
LogP ≤ 55.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2,5-diethoxyphenyl)-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide?
The IUPAC name of N-(2,5-diethoxyphenyl)-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide (CID 24617344) is N-(2,5-diethoxyphenyl)-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide.
What is the SMILES notation for N-(2,5-diethoxyphenyl)-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide?
The canonical SMILES for N-(2,5-diethoxyphenyl)-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide is CCOc1ccc(OCC)c(NC(=O)c2ccc(OCc3cn4cc(C)ccc4n3)cc2)c1.
What is the InChIKey of N-(2,5-diethoxyphenyl)-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide?
The InChIKey is VQCURPZNJLQISU-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H27N3O4/c1-4-31-22-11-12-24(32-5-2)23(14-22)28-26(30)19-7-9-21(10-8-19)33-17-20-16-29-15-18(3)6-13-25(29)27-20/h6-16H,4-5,17H2,1-3H3,(H,28,30).
What are the key properties of N-(2,5-diethoxyphenyl)-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide?
N-(2,5-diethoxyphenyl)-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide has a molecular weight of 445.52 g/mol, XLogP of 5.27, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-diethoxyphenyl)-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide is sourced from PubChem (CID 24617344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).