N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-3-methylbenzenesulfonamide

C16H17N3O2S — CID 110735015

IUPACN-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-3-methylbenzenesulfonamide
SMILESCc1cccc(S(=O)(=O)Nc2ccc3nc(C)c(C)n3c2)c1
InChIInChI=1S/C16H17N3O2S/c1-11-5-4-6-15(9-11)22(20,21)18-14-7-8-16-17-12(2)13(3)19(16)10-14/h4-10,18H,1-3H3
InChIKeyDBFDYZBHVDMRCI-UHFFFAOYSA-N
MW315.40 g/mol
LogP3.06
Rot. Bonds3

About N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-3-methylbenzenesulfonamide

N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-3-methylbenzenesulfonamide (PubChem CID 110735015) has the molecular formula C16H17N3O2S and a molecular weight of 315.40 g/mol. Its IUPAC name is N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-3-methylbenzenesulfonamide.

Molecular Properties

Compound NameN-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-3-methylbenzenesulfonamide
PubChem CID110735015
Molecular FormulaC16H17N3O2S
Molecular Weight315.40 g/mol
Exact Mass315.10
IUPAC NameN-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-3-methylbenzenesulfonamide
SMILESCc1cccc(S(=O)(=O)Nc2ccc3nc(C)c(C)n3c2)c1
InChIInChI=1S/C16H17N3O2S/c1-11-5-4-6-15(9-11)22(20,21)18-14-7-8-16-17-12(2)13(3)19(16)10-14/h4-10,18H,1-3H3
InChIKeyDBFDYZBHVDMRCI-UHFFFAOYSA-N
XLogP3.06
TPSA63.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.40
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-3-methylbenzenesulfonamide?
The IUPAC name of N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-3-methylbenzenesulfonamide (CID 110735015) is N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-3-methylbenzenesulfonamide.
What is the SMILES notation for N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-3-methylbenzenesulfonamide?
The canonical SMILES for N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-3-methylbenzenesulfonamide is Cc1cccc(S(=O)(=O)Nc2ccc3nc(C)c(C)n3c2)c1.
What is the InChIKey of N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-3-methylbenzenesulfonamide?
The InChIKey is DBFDYZBHVDMRCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2S/c1-11-5-4-6-15(9-11)22(20,21)18-14-7-8-16-17-12(2)13(3)19(16)10-14/h4-10,18H,1-3H3.
What are the key properties of N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-3-methylbenzenesulfonamide?
N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-3-methylbenzenesulfonamide has a molecular weight of 315.40 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-3-methylbenzenesulfonamide is sourced from PubChem (CID 110735015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).