2-chloro-N-(2-methoxyethyl)-4-[[3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]benzamide

C26H25ClN4O4 — CID 55877255

IUPAC2-chloro-N-(2-methoxyethyl)-4-[[3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]benzamide
SMILESCOCCNC(=O)c1ccc(NC(=O)c2cccc(OCc3cn4cc(C)ccc4n3)c2)cc1Cl
InChIInChI=1S/C26H25ClN4O4/c1-17-6-9-24-29-20(15-31(24)14-17)16-35-21-5-3-4-18(12-21)25(32)30-19-7-8-22(23(27)13-19)26(33)28-10-11-34-2/h3-9,12-15H,10-11,16H2,1-2H3,(H,28,33)(H,30,32)
InChIKeyHSQSEHPQVAIMDH-UHFFFAOYSA-N
MW492.96 g/mol
LogP4.50
Rot. Bonds9

About 2-chloro-N-(2-methoxyethyl)-4-[[3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]benzamide

2-chloro-N-(2-methoxyethyl)-4-[[3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]benzamide (PubChem CID 55877255) has the molecular formula C26H25ClN4O4 and a molecular weight of 492.96 g/mol. Its IUPAC name is 2-chloro-N-(2-methoxyethyl)-4-[[3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]benzamide.

Molecular Properties

Compound Name2-chloro-N-(2-methoxyethyl)-4-[[3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]benzamide
PubChem CID55877255
Molecular FormulaC26H25ClN4O4
Molecular Weight492.96 g/mol
Exact Mass492.16
IUPAC Name2-chloro-N-(2-methoxyethyl)-4-[[3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]benzamide
SMILESCOCCNC(=O)c1ccc(NC(=O)c2cccc(OCc3cn4cc(C)ccc4n3)c2)cc1Cl
InChIInChI=1S/C26H25ClN4O4/c1-17-6-9-24-29-20(15-31(24)14-17)16-35-21-5-3-4-18(12-21)25(32)30-19-7-8-22(23(27)13-19)26(33)28-10-11-34-2/h3-9,12-15H,10-11,16H2,1-2H3,(H,28,33)(H,30,32)
InChIKeyHSQSEHPQVAIMDH-UHFFFAOYSA-N
XLogP4.50
TPSA93.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500492.96
LogP ≤ 54.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2-methoxyethyl)-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 134024136
3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-propylbenzamide
CID 30661051
N-[4-(cyclopropylcarbamoyl)phenyl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 18287359
N-(4-chloro-2-methylphenyl)-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 41478728
N-ethyl-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 51112147
N-(2,5-dimethylphenyl)-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 42063589
N-(5-acetamido-2-methoxyphenyl)-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 24617141
N-[3-(methylamino)propyl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 119430842
N-(2-chloro-4-fluorophenyl)-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 24617005
methyl 2-[[3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]acetate
CID 52552732
N-[(4-methoxyphenyl)methyl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 24617007
3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-[3-(1-methyltetrazol-5-yl)phenyl]benzamide
CID 41478904

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2-methoxyethyl)-4-[[3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]benzamide?
The IUPAC name of 2-chloro-N-(2-methoxyethyl)-4-[[3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]benzamide (CID 55877255) is 2-chloro-N-(2-methoxyethyl)-4-[[3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]benzamide.
What is the SMILES notation for 2-chloro-N-(2-methoxyethyl)-4-[[3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]benzamide?
The canonical SMILES for 2-chloro-N-(2-methoxyethyl)-4-[[3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]benzamide is COCCNC(=O)c1ccc(NC(=O)c2cccc(OCc3cn4cc(C)ccc4n3)c2)cc1Cl.
What is the InChIKey of 2-chloro-N-(2-methoxyethyl)-4-[[3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]benzamide?
The InChIKey is HSQSEHPQVAIMDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25ClN4O4/c1-17-6-9-24-29-20(15-31(24)14-17)16-35-21-5-3-4-18(12-21)25(32)30-19-7-8-22(23(27)13-19)26(33)28-10-11-34-2/h3-9,12-15H,10-11,16H2,1-2H3,(H,28,33)(H,30,32).
What are the key properties of 2-chloro-N-(2-methoxyethyl)-4-[[3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]benzamide?
2-chloro-N-(2-methoxyethyl)-4-[[3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]benzamide has a molecular weight of 492.96 g/mol, XLogP of 4.50, 9 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2-methoxyethyl)-4-[[3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]benzamide is sourced from PubChem (CID 55877255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).