N-imidazo[1,2-a]pyridin-6-yl-5-methylsulfonyl-2-propan-2-yloxybenzamide

C18H19N3O4S — CID 136520529

IUPACN-imidazo[1,2-a]pyridin-6-yl-5-methylsulfonyl-2-propan-2-yloxybenzamide
SMILESCC(C)Oc1ccc(S(C)(=O)=O)cc1C(=O)Nc1ccc2nccn2c1
InChIInChI=1S/C18H19N3O4S/c1-12(2)25-16-6-5-14(26(3,23)24)10-15(16)18(22)20-13-4-7-17-19-8-9-21(17)11-13/h4-12H,1-3H3,(H,20,22)
InChIKeyHWSPBENZUPHCAF-UHFFFAOYSA-N
MW373.43 g/mol
LogP2.78
Rot. Bonds5

About N-imidazo[1,2-a]pyridin-6-yl-5-methylsulfonyl-2-propan-2-yloxybenzamide

N-imidazo[1,2-a]pyridin-6-yl-5-methylsulfonyl-2-propan-2-yloxybenzamide (PubChem CID 136520529) has the molecular formula C18H19N3O4S and a molecular weight of 373.43 g/mol. Its IUPAC name is N-imidazo[1,2-a]pyridin-6-yl-5-methylsulfonyl-2-propan-2-yloxybenzamide.

Molecular Properties

Compound NameN-imidazo[1,2-a]pyridin-6-yl-5-methylsulfonyl-2-propan-2-yloxybenzamide
PubChem CID136520529
Molecular FormulaC18H19N3O4S
Molecular Weight373.43 g/mol
Exact Mass373.11
IUPAC NameN-imidazo[1,2-a]pyridin-6-yl-5-methylsulfonyl-2-propan-2-yloxybenzamide
SMILESCC(C)Oc1ccc(S(C)(=O)=O)cc1C(=O)Nc1ccc2nccn2c1
InChIInChI=1S/C18H19N3O4S/c1-12(2)25-16-6-5-14(26(3,23)24)10-15(16)18(22)20-13-4-7-17-19-8-9-21(17)11-13/h4-12H,1-3H3,(H,20,22)
InChIKeyHWSPBENZUPHCAF-UHFFFAOYSA-N
XLogP2.78
TPSA89.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.43
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-imidazo[1,2-a]pyridin-6-yl-5-methylsulfonyl-2-propan-2-yloxybenzamide?
The IUPAC name of N-imidazo[1,2-a]pyridin-6-yl-5-methylsulfonyl-2-propan-2-yloxybenzamide (CID 136520529) is N-imidazo[1,2-a]pyridin-6-yl-5-methylsulfonyl-2-propan-2-yloxybenzamide.
What is the SMILES notation for N-imidazo[1,2-a]pyridin-6-yl-5-methylsulfonyl-2-propan-2-yloxybenzamide?
The canonical SMILES for N-imidazo[1,2-a]pyridin-6-yl-5-methylsulfonyl-2-propan-2-yloxybenzamide is CC(C)Oc1ccc(S(C)(=O)=O)cc1C(=O)Nc1ccc2nccn2c1.
What is the InChIKey of N-imidazo[1,2-a]pyridin-6-yl-5-methylsulfonyl-2-propan-2-yloxybenzamide?
The InChIKey is HWSPBENZUPHCAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O4S/c1-12(2)25-16-6-5-14(26(3,23)24)10-15(16)18(22)20-13-4-7-17-19-8-9-21(17)11-13/h4-12H,1-3H3,(H,20,22).
What are the key properties of N-imidazo[1,2-a]pyridin-6-yl-5-methylsulfonyl-2-propan-2-yloxybenzamide?
N-imidazo[1,2-a]pyridin-6-yl-5-methylsulfonyl-2-propan-2-yloxybenzamide has a molecular weight of 373.43 g/mol, XLogP of 2.78, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-imidazo[1,2-a]pyridin-6-yl-5-methylsulfonyl-2-propan-2-yloxybenzamide is sourced from PubChem (CID 136520529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).