2-butylimidazo[1,2-a]pyridine-3-sulfonyl chloride

C11H13ClN2O2S — CID 165499954

IUPAC2-butylimidazo[1,2-a]pyridine-3-sulfonyl chloride
SMILESCCCCc1nc2ccccn2c1S(=O)(=O)Cl
InChIInChI=1S/C11H13ClN2O2S/c1-2-3-6-9-11(17(12,15)16)14-8-5-4-7-10(14)13-9/h4-5,7-8H,2-3,6H2,1H3
InChIKeyKMHZIXJQQURYGD-UHFFFAOYSA-N
MW272.76 g/mol
LogP2.60
Rot. Bonds4

About 2-butylimidazo[1,2-a]pyridine-3-sulfonyl chloride

2-butylimidazo[1,2-a]pyridine-3-sulfonyl chloride (PubChem CID 165499954) has the molecular formula C11H13ClN2O2S and a molecular weight of 272.76 g/mol. Its IUPAC name is 2-butylimidazo[1,2-a]pyridine-3-sulfonyl chloride.

Molecular Properties

Compound Name2-butylimidazo[1,2-a]pyridine-3-sulfonyl chloride
PubChem CID165499954
Molecular FormulaC11H13ClN2O2S
Molecular Weight272.76 g/mol
Exact Mass272.04
IUPAC Name2-butylimidazo[1,2-a]pyridine-3-sulfonyl chloride
SMILESCCCCc1nc2ccccn2c1S(=O)(=O)Cl
InChIInChI=1S/C11H13ClN2O2S/c1-2-3-6-9-11(17(12,15)16)14-8-5-4-7-10(14)13-9/h4-5,7-8H,2-3,6H2,1H3
InChIKeyKMHZIXJQQURYGD-UHFFFAOYSA-N
XLogP2.60
TPSA51.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.76
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-butylimidazo[1,2-a]pyridine-3-sulfonyl chloride?
The IUPAC name of 2-butylimidazo[1,2-a]pyridine-3-sulfonyl chloride (CID 165499954) is 2-butylimidazo[1,2-a]pyridine-3-sulfonyl chloride.
What is the SMILES notation for 2-butylimidazo[1,2-a]pyridine-3-sulfonyl chloride?
The canonical SMILES for 2-butylimidazo[1,2-a]pyridine-3-sulfonyl chloride is CCCCc1nc2ccccn2c1S(=O)(=O)Cl.
What is the InChIKey of 2-butylimidazo[1,2-a]pyridine-3-sulfonyl chloride?
The InChIKey is KMHZIXJQQURYGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClN2O2S/c1-2-3-6-9-11(17(12,15)16)14-8-5-4-7-10(14)13-9/h4-5,7-8H,2-3,6H2,1H3.
What are the key properties of 2-butylimidazo[1,2-a]pyridine-3-sulfonyl chloride?
2-butylimidazo[1,2-a]pyridine-3-sulfonyl chloride has a molecular weight of 272.76 g/mol, XLogP of 2.60, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butylimidazo[1,2-a]pyridine-3-sulfonyl chloride is sourced from PubChem (CID 165499954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).