N-(2-imidazol-1-ylphenyl)-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide

C25H21N5O2 — CID 55911512

IUPACN-(2-imidazol-1-ylphenyl)-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
SMILESCc1ccc2nc(COc3cccc(C(=O)Nc4ccccc4-n4ccnc4)c3)cn2c1
InChIInChI=1S/C25H21N5O2/c1-18-9-10-24-27-20(15-30(24)14-18)16-32-21-6-4-5-19(13-21)25(31)28-22-7-2-3-8-23(22)29-12-11-26-17-29/h2-15,17H,16H2,1H3,(H,28,31)
InChIKeyYWFDJPTUTRNRHX-UHFFFAOYSA-N
MW423.48 g/mol
LogP4.66
Rot. Bonds6

About N-(2-imidazol-1-ylphenyl)-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide

N-(2-imidazol-1-ylphenyl)-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide (PubChem CID 55911512) has the molecular formula C25H21N5O2 and a molecular weight of 423.48 g/mol. Its IUPAC name is N-(2-imidazol-1-ylphenyl)-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide.

Molecular Properties

Compound NameN-(2-imidazol-1-ylphenyl)-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
PubChem CID55911512
Molecular FormulaC25H21N5O2
Molecular Weight423.48 g/mol
Exact Mass423.17
IUPAC NameN-(2-imidazol-1-ylphenyl)-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
SMILESCc1ccc2nc(COc3cccc(C(=O)Nc4ccccc4-n4ccnc4)c3)cn2c1
InChIInChI=1S/C25H21N5O2/c1-18-9-10-24-27-20(15-30(24)14-18)16-32-21-6-4-5-19(13-21)25(31)28-22-7-2-3-8-23(22)29-12-11-26-17-29/h2-15,17H,16H2,1H3,(H,28,31)
InChIKeyYWFDJPTUTRNRHX-UHFFFAOYSA-N
XLogP4.66
TPSA73.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms32
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.48
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-imidazol-1-ylphenyl)-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide?
The IUPAC name of N-(2-imidazol-1-ylphenyl)-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide (CID 55911512) is N-(2-imidazol-1-ylphenyl)-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide.
What is the SMILES notation for N-(2-imidazol-1-ylphenyl)-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide?
The canonical SMILES for N-(2-imidazol-1-ylphenyl)-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide is Cc1ccc2nc(COc3cccc(C(=O)Nc4ccccc4-n4ccnc4)c3)cn2c1.
What is the InChIKey of N-(2-imidazol-1-ylphenyl)-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide?
The InChIKey is YWFDJPTUTRNRHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21N5O2/c1-18-9-10-24-27-20(15-30(24)14-18)16-32-21-6-4-5-19(13-21)25(31)28-22-7-2-3-8-23(22)29-12-11-26-17-29/h2-15,17H,16H2,1H3,(H,28,31).
What are the key properties of N-(2-imidazol-1-ylphenyl)-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide?
N-(2-imidazol-1-ylphenyl)-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide has a molecular weight of 423.48 g/mol, XLogP of 4.66, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-imidazol-1-ylphenyl)-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide is sourced from PubChem (CID 55911512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).