3-[(4-ethoxyphenyl)sulfonylamino]-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide

C24H24N4O4S — CID 25430428

IUPAC3-[(4-ethoxyphenyl)sulfonylamino]-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide
SMILESCCOc1ccc(S(=O)(=O)Nc2cccc(C(=O)NCCc3cn4ccccc4n3)c2)cc1
InChIInChI=1S/C24H24N4O4S/c1-2-32-21-9-11-22(12-10-21)33(30,31)27-19-7-5-6-18(16-19)24(29)25-14-13-20-17-28-15-4-3-8-23(28)26-20/h3-12,15-17,27H,2,13-14H2,1H3,(H,25,29)
InChIKeyREDOJCDTVARKAF-UHFFFAOYSA-N
MW464.55 g/mol
LogP3.51
Rot. Bonds9

About 3-[(4-ethoxyphenyl)sulfonylamino]-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide

3-[(4-ethoxyphenyl)sulfonylamino]-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide (PubChem CID 25430428) has the molecular formula C24H24N4O4S and a molecular weight of 464.55 g/mol. Its IUPAC name is 3-[(4-ethoxyphenyl)sulfonylamino]-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide.

Molecular Properties

Compound Name3-[(4-ethoxyphenyl)sulfonylamino]-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide
PubChem CID25430428
Molecular FormulaC24H24N4O4S
Molecular Weight464.55 g/mol
Exact Mass464.15
IUPAC Name3-[(4-ethoxyphenyl)sulfonylamino]-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide
SMILESCCOc1ccc(S(=O)(=O)Nc2cccc(C(=O)NCCc3cn4ccccc4n3)c2)cc1
InChIInChI=1S/C24H24N4O4S/c1-2-32-21-9-11-22(12-10-21)33(30,31)27-19-7-5-6-18(16-19)24(29)25-14-13-20-17-28-15-4-3-8-23(28)26-20/h3-12,15-17,27H,2,13-14H2,1H3,(H,25,29)
InChIKeyREDOJCDTVARKAF-UHFFFAOYSA-N
XLogP3.51
TPSA101.80 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500464.55
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-[(4-butylphenyl)sulfamoyl]-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide
CID 32831947
4-ethoxy-N-[2-(2-imidazo[1,2-a]pyridin-2-ylethylamino)-2-oxoethyl]benzamide
CID 25429958
2-(4-ethoxyphenoxy)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)acetamide
CID 42017579
3-[(4-ethoxyphenyl)sulfonylamino]-N-[2-(1H-indol-3-yl)ethyl]benzamide
CID 26710792
N-(2-amino-2-oxoethyl)-3-[(4-ethoxyphenyl)sulfonylamino]benzamide
CID 9295740
3-[(4-ethoxyphenyl)sulfonylamino]-N-[3-(4-ethylpiperazin-1-yl)propyl]benzamide
CID 55660110
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-3,5-dimethoxybenzamide
CID 41463533
3-[(4-ethoxyphenyl)sulfonylamino]-N-[(2S)-2-phenyl-2-pyrrolidin-1-ylethyl]benzamide
CID 25472628
1-[[3-[(4-ethoxyphenyl)sulfonylamino]benzoyl]amino]-3-(2-phenylethyl)thiourea
CID 4847637
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[4-(methylsulfamoyl)phenyl]benzamide
CID 27711748
N-[4-(3,5-dimethylpiperidin-1-yl)butyl]-3-[(4-ethoxyphenyl)sulfonylamino]benzamide
CID 55847760
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[3-(methylamino)propyl]benzamide
CID 119431980

Frequently Asked Questions

What is the IUPAC name of 3-[(4-ethoxyphenyl)sulfonylamino]-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide?
The IUPAC name of 3-[(4-ethoxyphenyl)sulfonylamino]-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide (CID 25430428) is 3-[(4-ethoxyphenyl)sulfonylamino]-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide.
What is the SMILES notation for 3-[(4-ethoxyphenyl)sulfonylamino]-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide?
The canonical SMILES for 3-[(4-ethoxyphenyl)sulfonylamino]-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide is CCOc1ccc(S(=O)(=O)Nc2cccc(C(=O)NCCc3cn4ccccc4n3)c2)cc1.
What is the InChIKey of 3-[(4-ethoxyphenyl)sulfonylamino]-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide?
The InChIKey is REDOJCDTVARKAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O4S/c1-2-32-21-9-11-22(12-10-21)33(30,31)27-19-7-5-6-18(16-19)24(29)25-14-13-20-17-28-15-4-3-8-23(28)26-20/h3-12,15-17,27H,2,13-14H2,1H3,(H,25,29).
What are the key properties of 3-[(4-ethoxyphenyl)sulfonylamino]-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide?
3-[(4-ethoxyphenyl)sulfonylamino]-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide has a molecular weight of 464.55 g/mol, XLogP of 3.51, 9 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-ethoxyphenyl)sulfonylamino]-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide is sourced from PubChem (CID 25430428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).