6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-N-pentan-3-ylpyridine-3-sulfonamide

C22H30N6O2S — CID 55816285

IUPAC6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-N-pentan-3-ylpyridine-3-sulfonamide
SMILESCCC(CC)NS(=O)(=O)c1ccc(N2CCN(Cc3cn4ccccc4n3)CC2)nc1
InChIInChI=1S/C22H30N6O2S/c1-3-18(4-2)25-31(29,30)20-8-9-21(23-15-20)27-13-11-26(12-14-27)16-19-17-28-10-6-5-7-22(28)24-19/h5-10,15,17-18,25H,3-4,11-14,16H2,1-2H3
InChIKeyYWDSYXYZXFSKMX-UHFFFAOYSA-N
MW442.59 g/mol
LogP2.52
Rot. Bonds8

About 6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-N-pentan-3-ylpyridine-3-sulfonamide

6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-N-pentan-3-ylpyridine-3-sulfonamide (PubChem CID 55816285) has the molecular formula C22H30N6O2S and a molecular weight of 442.59 g/mol. Its IUPAC name is 6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-N-pentan-3-ylpyridine-3-sulfonamide.

Molecular Properties

Compound Name6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-N-pentan-3-ylpyridine-3-sulfonamide
PubChem CID55816285
Molecular FormulaC22H30N6O2S
Molecular Weight442.59 g/mol
Exact Mass442.22
IUPAC Name6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-N-pentan-3-ylpyridine-3-sulfonamide
SMILESCCC(CC)NS(=O)(=O)c1ccc(N2CCN(Cc3cn4ccccc4n3)CC2)nc1
InChIInChI=1S/C22H30N6O2S/c1-3-18(4-2)25-31(29,30)20-8-9-21(23-15-20)27-13-11-26(12-14-27)16-19-17-28-10-6-5-7-22(28)24-19/h5-10,15,17-18,25H,3-4,11-14,16H2,1-2H3
InChIKeyYWDSYXYZXFSKMX-UHFFFAOYSA-N
XLogP2.52
TPSA82.84 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500442.59
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-N-pentan-3-ylpyridine-3-sulfonamide with MolForge

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Related Compounds

6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-N,N-di(propan-2-yl)pyridine-3-sulfonamide
CID 55470803
2-[[4-[6-(trifluoromethyl)pyrimidin-4-yl]piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 154830033
5-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]sulfonyl-1,3-dihydrobenzimidazol-2-one
CID 146084118
2-[[4-(2-methylpropyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 45366493
N-ethyl-4-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-6-methylpyrimidin-2-amine
CID 155800877
2-[[4-(4-methylsulfonyl-2-nitrophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 18101778
2-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 22197062
2-[[4-(5-methylpyrimidin-4-yl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 163346240
2-[[4-[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 133273943
N-cyclopropyl-2-[4-[5-(pentan-3-ylsulfamoyl)-2-pyridinyl]piperazin-1-yl]propanamide
CID 55816286
2-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 4701931
2-[[4-[4-(trifluoromethyl)pyrimidin-2-yl]piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 55544599

Frequently Asked Questions

What is the IUPAC name of 6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-N-pentan-3-ylpyridine-3-sulfonamide?
The IUPAC name of 6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-N-pentan-3-ylpyridine-3-sulfonamide (CID 55816285) is 6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-N-pentan-3-ylpyridine-3-sulfonamide.
What is the SMILES notation for 6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-N-pentan-3-ylpyridine-3-sulfonamide?
The canonical SMILES for 6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-N-pentan-3-ylpyridine-3-sulfonamide is CCC(CC)NS(=O)(=O)c1ccc(N2CCN(Cc3cn4ccccc4n3)CC2)nc1.
What is the InChIKey of 6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-N-pentan-3-ylpyridine-3-sulfonamide?
The InChIKey is YWDSYXYZXFSKMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N6O2S/c1-3-18(4-2)25-31(29,30)20-8-9-21(23-15-20)27-13-11-26(12-14-27)16-19-17-28-10-6-5-7-22(28)24-19/h5-10,15,17-18,25H,3-4,11-14,16H2,1-2H3.
What are the key properties of 6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-N-pentan-3-ylpyridine-3-sulfonamide?
6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-N-pentan-3-ylpyridine-3-sulfonamide has a molecular weight of 442.59 g/mol, XLogP of 2.52, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-N-pentan-3-ylpyridine-3-sulfonamide is sourced from PubChem (CID 55816285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).