2-chloro-N-(2-methylbutyl)imidazo[1,2-a]pyridine-3-sulfonamide

C12H16ClN3O2S — CID 62693085

IUPAC2-chloro-N-(2-methylbutyl)imidazo[1,2-a]pyridine-3-sulfonamide
SMILESCCC(C)CNS(=O)(=O)c1c(Cl)nc2ccccn12
InChIInChI=1S/C12H16ClN3O2S/c1-3-9(2)8-14-19(17,18)12-11(13)15-10-6-4-5-7-16(10)12/h4-7,9,14H,3,8H2,1-2H3
InChIKeyDSZIJQNXEQFASY-UHFFFAOYSA-N
MW301.80 g/mol
LogP2.31
Rot. Bonds5

About 2-chloro-N-(2-methylbutyl)imidazo[1,2-a]pyridine-3-sulfonamide

2-chloro-N-(2-methylbutyl)imidazo[1,2-a]pyridine-3-sulfonamide (PubChem CID 62693085) has the molecular formula C12H16ClN3O2S and a molecular weight of 301.80 g/mol. Its IUPAC name is 2-chloro-N-(2-methylbutyl)imidazo[1,2-a]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-(2-methylbutyl)imidazo[1,2-a]pyridine-3-sulfonamide
PubChem CID62693085
Molecular FormulaC12H16ClN3O2S
Molecular Weight301.80 g/mol
Exact Mass301.07
IUPAC Name2-chloro-N-(2-methylbutyl)imidazo[1,2-a]pyridine-3-sulfonamide
SMILESCCC(C)CNS(=O)(=O)c1c(Cl)nc2ccccn12
InChIInChI=1S/C12H16ClN3O2S/c1-3-9(2)8-14-19(17,18)12-11(13)15-10-6-4-5-7-16(10)12/h4-7,9,14H,3,8H2,1-2H3
InChIKeyDSZIJQNXEQFASY-UHFFFAOYSA-N
XLogP2.31
TPSA63.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.80
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-[2-(dimethylamino)propyl]imidazo[1,2-a]pyridine-3-sulfonamide
CID 61045081
2-chloro-N-(2-cyclopropylpropyl)imidazo[1,2-a]pyridine-3-sulfonamide
CID 115591341
2-chloro-N-(2-cyclopropyl-2-hydroxyethyl)imidazo[1,2-a]pyridine-3-sulfonamide
CID 63296964
2-chloro-N-(1-hydroxybutan-2-yl)imidazo[1,2-a]pyridine-3-sulfonamide
CID 61052467
2-chloro-N-(2-hydroxy-2-methylbutyl)imidazo[1,2-a]pyridine-3-sulfonamide
CID 65107393
2-chloro-N-(3-ethoxypropyl)imidazo[1,2-a]pyridine-3-sulfonamide
CID 47254464
2-chloro-N-(3-methylsulfinylpropyl)imidazo[1,2-a]pyridine-3-sulfonamide
CID 115632039
2-chloro-N-[3-(dimethylamino)propyl]imidazo[1,2-a]pyridine-3-sulfonamide
CID 60812797
2-chloro-N-[(5-chlorothiophen-2-yl)methyl]imidazo[1,2-a]pyridine-3-sulfonamide
CID 61073000
2-chloro-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide
CID 47254419
2-chloro-N-(2-methyl-2-methylsulfanylpropyl)imidazo[1,2-a]pyridine-3-sulfonamide
CID 115663368
2-amino-N-(3-methoxy-2-methylpropyl)imidazo[1,2-a]pyridine-3-sulfonamide
CID 62156679

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2-methylbutyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The IUPAC name of 2-chloro-N-(2-methylbutyl)imidazo[1,2-a]pyridine-3-sulfonamide (CID 62693085) is 2-chloro-N-(2-methylbutyl)imidazo[1,2-a]pyridine-3-sulfonamide.
What is the SMILES notation for 2-chloro-N-(2-methylbutyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The canonical SMILES for 2-chloro-N-(2-methylbutyl)imidazo[1,2-a]pyridine-3-sulfonamide is CCC(C)CNS(=O)(=O)c1c(Cl)nc2ccccn12.
What is the InChIKey of 2-chloro-N-(2-methylbutyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The InChIKey is DSZIJQNXEQFASY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16ClN3O2S/c1-3-9(2)8-14-19(17,18)12-11(13)15-10-6-4-5-7-16(10)12/h4-7,9,14H,3,8H2,1-2H3.
What are the key properties of 2-chloro-N-(2-methylbutyl)imidazo[1,2-a]pyridine-3-sulfonamide?
2-chloro-N-(2-methylbutyl)imidazo[1,2-a]pyridine-3-sulfonamide has a molecular weight of 301.80 g/mol, XLogP of 2.31, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2-methylbutyl)imidazo[1,2-a]pyridine-3-sulfonamide is sourced from PubChem (CID 62693085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).