N-[6-methyl-2-oxo-1-(2-oxo-2-piperidin-1-ylethyl)-3-pyridinyl]benzenesulfonamide

C19H23N3O4S — CID 53161453

IUPACN-[6-methyl-2-oxo-1-(2-oxo-2-piperidin-1-ylethyl)-3-pyridinyl]benzenesulfonamide
SMILESCc1ccc(NS(=O)(=O)c2ccccc2)c(=O)n1CC(=O)N1CCCCC1
InChIInChI=1S/C19H23N3O4S/c1-15-10-11-17(20-27(25,26)16-8-4-2-5-9-16)19(24)22(15)14-18(23)21-12-6-3-7-13-21/h2,4-5,8-11,20H,3,6-7,12-14H2,1H3
InChIKeyCKBQHACHTZRPPC-UHFFFAOYSA-N
MW389.48 g/mol
LogP1.97
Rot. Bonds5

About N-[6-methyl-2-oxo-1-(2-oxo-2-piperidin-1-ylethyl)-3-pyridinyl]benzenesulfonamide

N-[6-methyl-2-oxo-1-(2-oxo-2-piperidin-1-ylethyl)-3-pyridinyl]benzenesulfonamide (PubChem CID 53161453) has the molecular formula C19H23N3O4S and a molecular weight of 389.48 g/mol. Its IUPAC name is N-[6-methyl-2-oxo-1-(2-oxo-2-piperidin-1-ylethyl)-3-pyridinyl]benzenesulfonamide.

Molecular Properties

Compound NameN-[6-methyl-2-oxo-1-(2-oxo-2-piperidin-1-ylethyl)-3-pyridinyl]benzenesulfonamide
PubChem CID53161453
Molecular FormulaC19H23N3O4S
Molecular Weight389.48 g/mol
Exact Mass389.14
IUPAC NameN-[6-methyl-2-oxo-1-(2-oxo-2-piperidin-1-ylethyl)-3-pyridinyl]benzenesulfonamide
SMILESCc1ccc(NS(=O)(=O)c2ccccc2)c(=O)n1CC(=O)N1CCCCC1
InChIInChI=1S/C19H23N3O4S/c1-15-10-11-17(20-27(25,26)16-8-4-2-5-9-16)19(24)22(15)14-18(23)21-12-6-3-7-13-21/h2,4-5,8-11,20H,3,6-7,12-14H2,1H3
InChIKeyCKBQHACHTZRPPC-UHFFFAOYSA-N
XLogP1.97
TPSA88.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.48
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[6-methyl-2-oxo-1-(2-oxo-2-piperidin-1-ylethyl)-3-pyridinyl]benzenesulfonamide?
The IUPAC name of N-[6-methyl-2-oxo-1-(2-oxo-2-piperidin-1-ylethyl)-3-pyridinyl]benzenesulfonamide (CID 53161453) is N-[6-methyl-2-oxo-1-(2-oxo-2-piperidin-1-ylethyl)-3-pyridinyl]benzenesulfonamide.
What is the SMILES notation for N-[6-methyl-2-oxo-1-(2-oxo-2-piperidin-1-ylethyl)-3-pyridinyl]benzenesulfonamide?
The canonical SMILES for N-[6-methyl-2-oxo-1-(2-oxo-2-piperidin-1-ylethyl)-3-pyridinyl]benzenesulfonamide is Cc1ccc(NS(=O)(=O)c2ccccc2)c(=O)n1CC(=O)N1CCCCC1.
What is the InChIKey of N-[6-methyl-2-oxo-1-(2-oxo-2-piperidin-1-ylethyl)-3-pyridinyl]benzenesulfonamide?
The InChIKey is CKBQHACHTZRPPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O4S/c1-15-10-11-17(20-27(25,26)16-8-4-2-5-9-16)19(24)22(15)14-18(23)21-12-6-3-7-13-21/h2,4-5,8-11,20H,3,6-7,12-14H2,1H3.
What are the key properties of N-[6-methyl-2-oxo-1-(2-oxo-2-piperidin-1-ylethyl)-3-pyridinyl]benzenesulfonamide?
N-[6-methyl-2-oxo-1-(2-oxo-2-piperidin-1-ylethyl)-3-pyridinyl]benzenesulfonamide has a molecular weight of 389.48 g/mol, XLogP of 1.97, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-methyl-2-oxo-1-(2-oxo-2-piperidin-1-ylethyl)-3-pyridinyl]benzenesulfonamide is sourced from PubChem (CID 53161453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).