3,8-dimethylimidazo[1,5-a]pyridine-1-sulfonyl chloride

C9H9ClN2O2S — CID 112552052

IUPAC3,8-dimethylimidazo[1,5-a]pyridine-1-sulfonyl chloride
SMILESCc1cccn2c(C)nc(S(=O)(=O)Cl)c12
InChIInChI=1S/C9H9ClN2O2S/c1-6-4-3-5-12-7(2)11-9(8(6)12)15(10,13)14/h3-5H,1-2H3
InChIKeyPBYOOPLMBYAGDF-UHFFFAOYSA-N
MW244.70 g/mol
LogP1.88
Rot. Bonds1

About 3,8-dimethylimidazo[1,5-a]pyridine-1-sulfonyl chloride

3,8-dimethylimidazo[1,5-a]pyridine-1-sulfonyl chloride (PubChem CID 112552052) has the molecular formula C9H9ClN2O2S and a molecular weight of 244.70 g/mol. Its IUPAC name is 3,8-dimethylimidazo[1,5-a]pyridine-1-sulfonyl chloride.

Molecular Properties

Compound Name3,8-dimethylimidazo[1,5-a]pyridine-1-sulfonyl chloride
PubChem CID112552052
Molecular FormulaC9H9ClN2O2S
Molecular Weight244.70 g/mol
Exact Mass244.01
IUPAC Name3,8-dimethylimidazo[1,5-a]pyridine-1-sulfonyl chloride
SMILESCc1cccn2c(C)nc(S(=O)(=O)Cl)c12
InChIInChI=1S/C9H9ClN2O2S/c1-6-4-3-5-12-7(2)11-9(8(6)12)15(10,13)14/h3-5H,1-2H3
InChIKeyPBYOOPLMBYAGDF-UHFFFAOYSA-N
XLogP1.88
TPSA51.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.70
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3,8-dimethylimidazo[1,5-a]pyridin-1-yl)ethanone
CID 84661486
3,7-dimethylimidazo[1,5-a]pyridine-1-sulfonyl chloride
CID 112552051
(3,8-dimethylimidazo[1,5-a]pyridin-1-yl)methanamine
CID 83827526
3-ethyl-8-methyl-N-propan-2-ylimidazo[1,5-a]pyridine-1-sulfonamide
CID 112552315
8-methyl-3-propylimidazo[1,5-a]pyridine-1-sulfonamide
CID 112552475
3-ethyl-8-methyl-N-propylimidazo[1,5-a]pyridine-1-sulfonamide
CID 112552328
8-methyl-N,3-dipropylimidazo[1,5-a]pyridine-1-sulfonamide
CID 112552540
1-chloro-3-(2,2-dimethylpropyl)-8-methylimidazo[1,5-a]pyridine
CID 117252428
3-iodo-5-methyl-6-(trifluoromethoxy)pyridine-2-sulfonyl chloride
CID 131369994
2-(8-chloro-3-methylimidazo[1,5-a]pyridin-1-yl)acetic acid
CID 83869363
1-(1-chloro-8-methylimidazo[1,5-a]pyridin-3-yl)-N-methylethanamine
CID 117254902
1-chloro-8-methyl-3-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridine
CID 117252634

Frequently Asked Questions

What is the IUPAC name of 3,8-dimethylimidazo[1,5-a]pyridine-1-sulfonyl chloride?
The IUPAC name of 3,8-dimethylimidazo[1,5-a]pyridine-1-sulfonyl chloride (CID 112552052) is 3,8-dimethylimidazo[1,5-a]pyridine-1-sulfonyl chloride.
What is the SMILES notation for 3,8-dimethylimidazo[1,5-a]pyridine-1-sulfonyl chloride?
The canonical SMILES for 3,8-dimethylimidazo[1,5-a]pyridine-1-sulfonyl chloride is Cc1cccn2c(C)nc(S(=O)(=O)Cl)c12.
What is the InChIKey of 3,8-dimethylimidazo[1,5-a]pyridine-1-sulfonyl chloride?
The InChIKey is PBYOOPLMBYAGDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9ClN2O2S/c1-6-4-3-5-12-7(2)11-9(8(6)12)15(10,13)14/h3-5H,1-2H3.
What are the key properties of 3,8-dimethylimidazo[1,5-a]pyridine-1-sulfonyl chloride?
3,8-dimethylimidazo[1,5-a]pyridine-1-sulfonyl chloride has a molecular weight of 244.70 g/mol, XLogP of 1.88, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,8-dimethylimidazo[1,5-a]pyridine-1-sulfonyl chloride is sourced from PubChem (CID 112552052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).