N,N-diethyl-1-(imidazo[1,2-a]pyridin-2-ylmethyl)-6-oxopyridine-3-sulfonamide

C17H20N4O3S — CID 38867518

IUPACN,N-diethyl-1-(imidazo[1,2-a]pyridin-2-ylmethyl)-6-oxopyridine-3-sulfonamide
SMILESCCN(CC)S(=O)(=O)c1ccc(=O)n(Cc2cn3ccccc3n2)c1
InChIInChI=1S/C17H20N4O3S/c1-3-21(4-2)25(23,24)15-8-9-17(22)20(13-15)12-14-11-19-10-6-5-7-16(19)18-14/h5-11,13H,3-4,12H2,1-2H3
InChIKeyMFERDHSBXIUOJM-UHFFFAOYSA-N
MW360.44 g/mol
LogP1.57
Rot. Bonds6

About N,N-diethyl-1-(imidazo[1,2-a]pyridin-2-ylmethyl)-6-oxopyridine-3-sulfonamide

N,N-diethyl-1-(imidazo[1,2-a]pyridin-2-ylmethyl)-6-oxopyridine-3-sulfonamide (PubChem CID 38867518) has the molecular formula C17H20N4O3S and a molecular weight of 360.44 g/mol. Its IUPAC name is N,N-diethyl-1-(imidazo[1,2-a]pyridin-2-ylmethyl)-6-oxopyridine-3-sulfonamide.

Molecular Properties

Compound NameN,N-diethyl-1-(imidazo[1,2-a]pyridin-2-ylmethyl)-6-oxopyridine-3-sulfonamide
PubChem CID38867518
Molecular FormulaC17H20N4O3S
Molecular Weight360.44 g/mol
Exact Mass360.13
IUPAC NameN,N-diethyl-1-(imidazo[1,2-a]pyridin-2-ylmethyl)-6-oxopyridine-3-sulfonamide
SMILESCCN(CC)S(=O)(=O)c1ccc(=O)n(Cc2cn3ccccc3n2)c1
InChIInChI=1S/C17H20N4O3S/c1-3-21(4-2)25(23,24)15-8-9-17(22)20(13-15)12-14-11-19-10-6-5-7-16(19)18-14/h5-11,13H,3-4,12H2,1-2H3
InChIKeyMFERDHSBXIUOJM-UHFFFAOYSA-N
XLogP1.57
TPSA76.68 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.44
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

1-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(trifluoromethyl)pyridin-2-one
CID 38846572
N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine
CID 4701920
6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-N,N-di(propan-2-yl)pyridine-3-sulfonamide
CID 55470803
4-chloro-3-(diethylsulfamoyl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)benzamide
CID 8917124
2-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 22197062
1-imidazo[1,2-a]pyridin-2-yl-N-methylmethanesulfonamide
CID 165442818
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N,N-dipropylacetamide
CID 55400476
1-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methylpyrrole-3-carboxylic acid
CID 114189454
N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 25406414
ethane;imidazo[1,2-a]pyridin-2-ylmethanol
CID 91126513
phenacyl 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]acetate
CID 7977627
2-[ethyl(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid
CID 54900006

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-1-(imidazo[1,2-a]pyridin-2-ylmethyl)-6-oxopyridine-3-sulfonamide?
The IUPAC name of N,N-diethyl-1-(imidazo[1,2-a]pyridin-2-ylmethyl)-6-oxopyridine-3-sulfonamide (CID 38867518) is N,N-diethyl-1-(imidazo[1,2-a]pyridin-2-ylmethyl)-6-oxopyridine-3-sulfonamide.
What is the SMILES notation for N,N-diethyl-1-(imidazo[1,2-a]pyridin-2-ylmethyl)-6-oxopyridine-3-sulfonamide?
The canonical SMILES for N,N-diethyl-1-(imidazo[1,2-a]pyridin-2-ylmethyl)-6-oxopyridine-3-sulfonamide is CCN(CC)S(=O)(=O)c1ccc(=O)n(Cc2cn3ccccc3n2)c1.
What is the InChIKey of N,N-diethyl-1-(imidazo[1,2-a]pyridin-2-ylmethyl)-6-oxopyridine-3-sulfonamide?
The InChIKey is MFERDHSBXIUOJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O3S/c1-3-21(4-2)25(23,24)15-8-9-17(22)20(13-15)12-14-11-19-10-6-5-7-16(19)18-14/h5-11,13H,3-4,12H2,1-2H3.
What are the key properties of N,N-diethyl-1-(imidazo[1,2-a]pyridin-2-ylmethyl)-6-oxopyridine-3-sulfonamide?
N,N-diethyl-1-(imidazo[1,2-a]pyridin-2-ylmethyl)-6-oxopyridine-3-sulfonamide has a molecular weight of 360.44 g/mol, XLogP of 1.57, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1-(imidazo[1,2-a]pyridin-2-ylmethyl)-6-oxopyridine-3-sulfonamide is sourced from PubChem (CID 38867518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).