2-chloro-N-[1-(furan-2-yl)ethyl]imidazo[1,2-a]pyridine-3-sulfonamide

C13H12ClN3O3S — CID 60814816

IUPAC2-chloro-N-[1-(furan-2-yl)ethyl]imidazo[1,2-a]pyridine-3-sulfonamide
SMILESCC(NS(=O)(=O)c1c(Cl)nc2ccccn12)c1ccco1
InChIInChI=1S/C13H12ClN3O3S/c1-9(10-5-4-8-20-10)16-21(18,19)13-12(14)15-11-6-2-3-7-17(11)13/h2-9,16H,1H3
InChIKeyMFGGBKKJALGOFB-UHFFFAOYSA-N
MW325.78 g/mol
LogP2.62
Rot. Bonds4

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

2-chloro-N-[1-(furan-2-yl)ethyl]imidazo[1,2-a]pyridine-3-sulfonamide (PubChem CID 60814816) has the molecular formula C13H12ClN3O3S and a molecular weight of 325.78 g/mol. Its IUPAC name is 2-chloro-N-[1-(furan-2-yl)ethyl]imidazo[1,2-a]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-[1-(furan-2-yl)ethyl]imidazo[1,2-a]pyridine-3-sulfonamide
PubChem CID60814816
Molecular FormulaC13H12ClN3O3S
Molecular Weight325.78 g/mol
Exact Mass325.03
IUPAC Name2-chloro-N-[1-(furan-2-yl)ethyl]imidazo[1,2-a]pyridine-3-sulfonamide
SMILESCC(NS(=O)(=O)c1c(Cl)nc2ccccn12)c1ccco1
InChIInChI=1S/C13H12ClN3O3S/c1-9(10-5-4-8-20-10)16-21(18,19)13-12(14)15-11-6-2-3-7-17(11)13/h2-9,16H,1H3
InChIKeyMFGGBKKJALGOFB-UHFFFAOYSA-N
XLogP2.62
TPSA76.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.78
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[1-(furan-2-yl)ethyl]imidazo[1,2-a]pyridine-3-sulfonamide?
The IUPAC name of 2-chloro-N-[1-(furan-2-yl)ethyl]imidazo[1,2-a]pyridine-3-sulfonamide (CID 60814816) is 2-chloro-N-[1-(furan-2-yl)ethyl]imidazo[1,2-a]pyridine-3-sulfonamide.
What is the SMILES notation for 2-chloro-N-[1-(furan-2-yl)ethyl]imidazo[1,2-a]pyridine-3-sulfonamide?
The canonical SMILES for 2-chloro-N-[1-(furan-2-yl)ethyl]imidazo[1,2-a]pyridine-3-sulfonamide is CC(NS(=O)(=O)c1c(Cl)nc2ccccn12)c1ccco1.
What is the InChIKey of 2-chloro-N-[1-(furan-2-yl)ethyl]imidazo[1,2-a]pyridine-3-sulfonamide?
The InChIKey is MFGGBKKJALGOFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClN3O3S/c1-9(10-5-4-8-20-10)16-21(18,19)13-12(14)15-11-6-2-3-7-17(11)13/h2-9,16H,1H3.
What are the key properties of 2-chloro-N-[1-(furan-2-yl)ethyl]imidazo[1,2-a]pyridine-3-sulfonamide?
2-chloro-N-[1-(furan-2-yl)ethyl]imidazo[1,2-a]pyridine-3-sulfonamide has a molecular weight of 325.78 g/mol, XLogP of 2.62, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[1-(furan-2-yl)ethyl]imidazo[1,2-a]pyridine-3-sulfonamide is sourced from PubChem (CID 60814816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).