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

C12H16ClN3O3S — CID 47254464

IUPAC2-chloro-N-(3-ethoxypropyl)imidazo[1,2-a]pyridine-3-sulfonamide
SMILESCCOCCCNS(=O)(=O)c1c(Cl)nc2ccccn12
InChIInChI=1S/C12H16ClN3O3S/c1-2-19-9-5-7-14-20(17,18)12-11(13)15-10-6-3-4-8-16(10)12/h3-4,6,8,14H,2,5,7,9H2,1H3
InChIKeyBSGYMEXIPNCWTL-UHFFFAOYSA-N
MW317.80 g/mol
LogP1.69
Rot. Bonds7

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

2-chloro-N-(3-ethoxypropyl)imidazo[1,2-a]pyridine-3-sulfonamide (PubChem CID 47254464) has the molecular formula C12H16ClN3O3S and a molecular weight of 317.80 g/mol. Its IUPAC name is 2-chloro-N-(3-ethoxypropyl)imidazo[1,2-a]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-(3-ethoxypropyl)imidazo[1,2-a]pyridine-3-sulfonamide
PubChem CID47254464
Molecular FormulaC12H16ClN3O3S
Molecular Weight317.80 g/mol
Exact Mass317.06
IUPAC Name2-chloro-N-(3-ethoxypropyl)imidazo[1,2-a]pyridine-3-sulfonamide
SMILESCCOCCCNS(=O)(=O)c1c(Cl)nc2ccccn12
InChIInChI=1S/C12H16ClN3O3S/c1-2-19-9-5-7-14-20(17,18)12-11(13)15-10-6-3-4-8-16(10)12/h3-4,6,8,14H,2,5,7,9H2,1H3
InChIKeyBSGYMEXIPNCWTL-UHFFFAOYSA-N
XLogP1.69
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.80
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(Ethanesulfonyl)imidazo(1,2-a)pyridine-3-sulfonamide
CID 15477602
(2-Ethylsulfonylimidazo[1,2-a]pyridin-3-yl)sulfonylurea
CID 91103679
Ulfosulfuron guanidine
CID 101134254
2-Chloroimidazo[1,2-a]pyridine-3-sulfonamide
CID 14422354
Imidazo(1,2-a)pyridine-3-sulfonamide
CID 14422439
Imidazo[1,2-a]pyridine-3-sulfonyl chloride
CID 53256697
Imidazo[1,2-a]pyridine-2-sulfonyl chloride
CID 121420066
2,7-Dichloroimidazo[1,2-a]pyridine-3-sulfonyl chloride
CID 82530117
1-Methylimidazo[1,2-a]pyridin-4-ium-6-sulfonic acid
CID 3553603
2-(Ethylthio)imidazo[1,2-a]pyridine-3-sulfonamide
CID 14422447
Imidazo[1,2-a]pyridine-2-sulfonamide
CID 67959461
5-chloro-1-methyl-N-(pyridin-2-ylmethyl)imidazole-4-sulfonamide
CID 35291463

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(3-ethoxypropyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The IUPAC name of 2-chloro-N-(3-ethoxypropyl)imidazo[1,2-a]pyridine-3-sulfonamide (CID 47254464) is 2-chloro-N-(3-ethoxypropyl)imidazo[1,2-a]pyridine-3-sulfonamide.
What is the SMILES notation for 2-chloro-N-(3-ethoxypropyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The canonical SMILES for 2-chloro-N-(3-ethoxypropyl)imidazo[1,2-a]pyridine-3-sulfonamide is CCOCCCNS(=O)(=O)c1c(Cl)nc2ccccn12.
What is the InChIKey of 2-chloro-N-(3-ethoxypropyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The InChIKey is BSGYMEXIPNCWTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16ClN3O3S/c1-2-19-9-5-7-14-20(17,18)12-11(13)15-10-6-3-4-8-16(10)12/h3-4,6,8,14H,2,5,7,9H2,1H3.
What are the key properties of 2-chloro-N-(3-ethoxypropyl)imidazo[1,2-a]pyridine-3-sulfonamide?
2-chloro-N-(3-ethoxypropyl)imidazo[1,2-a]pyridine-3-sulfonamide has a molecular weight of 317.80 g/mol, XLogP of 1.69, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(3-ethoxypropyl)imidazo[1,2-a]pyridine-3-sulfonamide is sourced from PubChem (CID 47254464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).