2-(oxolan-3-yl)imidazo[1,2-a]pyridine-3-sulfonyl chloride

C11H11ClN2O3S — CID 165499953

IUPAC2-(oxolan-3-yl)imidazo[1,2-a]pyridine-3-sulfonyl chloride
SMILESO=S(=O)(Cl)c1c(C2CCOC2)nc2ccccn12
InChIInChI=1S/C11H11ClN2O3S/c12-18(15,16)11-10(8-4-6-17-7-8)13-9-3-1-2-5-14(9)11/h1-3,5,8H,4,6-7H2
InChIKeyKBCFLVVQRLOVRO-UHFFFAOYSA-N
MW286.74 g/mol
LogP1.77
Rot. Bonds2

About 2-(oxolan-3-yl)imidazo[1,2-a]pyridine-3-sulfonyl chloride

2-(oxolan-3-yl)imidazo[1,2-a]pyridine-3-sulfonyl chloride (PubChem CID 165499953) has the molecular formula C11H11ClN2O3S and a molecular weight of 286.74 g/mol. Its IUPAC name is 2-(oxolan-3-yl)imidazo[1,2-a]pyridine-3-sulfonyl chloride.

Molecular Properties

Compound Name2-(oxolan-3-yl)imidazo[1,2-a]pyridine-3-sulfonyl chloride
PubChem CID165499953
Molecular FormulaC11H11ClN2O3S
Molecular Weight286.74 g/mol
Exact Mass286.02
IUPAC Name2-(oxolan-3-yl)imidazo[1,2-a]pyridine-3-sulfonyl chloride
SMILESO=S(=O)(Cl)c1c(C2CCOC2)nc2ccccn12
InChIInChI=1S/C11H11ClN2O3S/c12-18(15,16)11-10(8-4-6-17-7-8)13-9-3-1-2-5-14(9)11/h1-3,5,8H,4,6-7H2
InChIKeyKBCFLVVQRLOVRO-UHFFFAOYSA-N
XLogP1.77
TPSA60.67 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.74
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(oxolan-3-yl)imidazo[1,2-a]pyridine-3-sulfonyl chloride?
The IUPAC name of 2-(oxolan-3-yl)imidazo[1,2-a]pyridine-3-sulfonyl chloride (CID 165499953) is 2-(oxolan-3-yl)imidazo[1,2-a]pyridine-3-sulfonyl chloride.
What is the SMILES notation for 2-(oxolan-3-yl)imidazo[1,2-a]pyridine-3-sulfonyl chloride?
The canonical SMILES for 2-(oxolan-3-yl)imidazo[1,2-a]pyridine-3-sulfonyl chloride is O=S(=O)(Cl)c1c(C2CCOC2)nc2ccccn12.
What is the InChIKey of 2-(oxolan-3-yl)imidazo[1,2-a]pyridine-3-sulfonyl chloride?
The InChIKey is KBCFLVVQRLOVRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClN2O3S/c12-18(15,16)11-10(8-4-6-17-7-8)13-9-3-1-2-5-14(9)11/h1-3,5,8H,4,6-7H2.
What are the key properties of 2-(oxolan-3-yl)imidazo[1,2-a]pyridine-3-sulfonyl chloride?
2-(oxolan-3-yl)imidazo[1,2-a]pyridine-3-sulfonyl chloride has a molecular weight of 286.74 g/mol, XLogP of 1.77, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxolan-3-yl)imidazo[1,2-a]pyridine-3-sulfonyl chloride is sourced from PubChem (CID 165499953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).