5-(3-cyclopentylsulfonylimidazo[1,2-a]pyridin-6-yl)-1,3-dimethylpyridin-2-one

C19H21N3O3S — CID 129070256

IUPAC5-(3-cyclopentylsulfonylimidazo[1,2-a]pyridin-6-yl)-1,3-dimethylpyridin-2-one
SMILESCc1cc(-c2ccc3ncc(S(=O)(=O)C4CCCC4)n3c2)cn(C)c1=O
InChIInChI=1S/C19H21N3O3S/c1-13-9-15(11-21(2)19(13)23)14-7-8-17-20-10-18(22(17)12-14)26(24,25)16-5-3-4-6-16/h7-12,16H,3-6H2,1-2H3
InChIKeyYKKVZVIHZWTJIX-UHFFFAOYSA-N
MW371.46 g/mol
LogP2.72
Rot. Bonds3

About 5-(3-cyclopentylsulfonylimidazo[1,2-a]pyridin-6-yl)-1,3-dimethylpyridin-2-one

5-(3-cyclopentylsulfonylimidazo[1,2-a]pyridin-6-yl)-1,3-dimethylpyridin-2-one (PubChem CID 129070256) has the molecular formula C19H21N3O3S and a molecular weight of 371.46 g/mol. Its IUPAC name is 5-(3-cyclopentylsulfonylimidazo[1,2-a]pyridin-6-yl)-1,3-dimethylpyridin-2-one.

Molecular Properties

Compound Name5-(3-cyclopentylsulfonylimidazo[1,2-a]pyridin-6-yl)-1,3-dimethylpyridin-2-one
PubChem CID129070256
Molecular FormulaC19H21N3O3S
Molecular Weight371.46 g/mol
Exact Mass371.13
IUPAC Name5-(3-cyclopentylsulfonylimidazo[1,2-a]pyridin-6-yl)-1,3-dimethylpyridin-2-one
SMILESCc1cc(-c2ccc3ncc(S(=O)(=O)C4CCCC4)n3c2)cn(C)c1=O
InChIInChI=1S/C19H21N3O3S/c1-13-9-15(11-21(2)19(13)23)14-7-8-17-20-10-18(22(17)12-14)26(24,25)16-5-3-4-6-16/h7-12,16H,3-6H2,1-2H3
InChIKeyYKKVZVIHZWTJIX-UHFFFAOYSA-N
XLogP2.72
TPSA73.44 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.46
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(3-cyclopentylsulfonylimidazo[1,2-a]pyridin-6-yl)-1,3-dimethylpyridin-2-one?
The IUPAC name of 5-(3-cyclopentylsulfonylimidazo[1,2-a]pyridin-6-yl)-1,3-dimethylpyridin-2-one (CID 129070256) is 5-(3-cyclopentylsulfonylimidazo[1,2-a]pyridin-6-yl)-1,3-dimethylpyridin-2-one.
What is the SMILES notation for 5-(3-cyclopentylsulfonylimidazo[1,2-a]pyridin-6-yl)-1,3-dimethylpyridin-2-one?
The canonical SMILES for 5-(3-cyclopentylsulfonylimidazo[1,2-a]pyridin-6-yl)-1,3-dimethylpyridin-2-one is Cc1cc(-c2ccc3ncc(S(=O)(=O)C4CCCC4)n3c2)cn(C)c1=O.
What is the InChIKey of 5-(3-cyclopentylsulfonylimidazo[1,2-a]pyridin-6-yl)-1,3-dimethylpyridin-2-one?
The InChIKey is YKKVZVIHZWTJIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O3S/c1-13-9-15(11-21(2)19(13)23)14-7-8-17-20-10-18(22(17)12-14)26(24,25)16-5-3-4-6-16/h7-12,16H,3-6H2,1-2H3.
What are the key properties of 5-(3-cyclopentylsulfonylimidazo[1,2-a]pyridin-6-yl)-1,3-dimethylpyridin-2-one?
5-(3-cyclopentylsulfonylimidazo[1,2-a]pyridin-6-yl)-1,3-dimethylpyridin-2-one has a molecular weight of 371.46 g/mol, XLogP of 2.72, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-cyclopentylsulfonylimidazo[1,2-a]pyridin-6-yl)-1,3-dimethylpyridin-2-one is sourced from PubChem (CID 129070256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).