2-(2,6-dimethyl-4-oxo-1-pyridinyl)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide

C19H23N3O5S — CID 108806474

IUPAC2-(2,6-dimethyl-4-oxo-1-pyridinyl)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide
SMILESCc1cc(=O)cc(C)n1CC(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1
InChIInChI=1S/C19H23N3O5S/c1-14-11-17(23)12-15(2)22(14)13-19(24)20-16-3-5-18(6-4-16)28(25,26)21-7-9-27-10-8-21/h3-6,11-12H,7-10,13H2,1-2H3,(H,20,24)
InChIKeySYHYUYHVJNPXNN-UHFFFAOYSA-N
MW405.48 g/mol
LogP1.12
Rot. Bonds5

About 2-(2,6-dimethyl-4-oxo-1-pyridinyl)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide

2-(2,6-dimethyl-4-oxo-1-pyridinyl)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide (PubChem CID 108806474) has the molecular formula C19H23N3O5S and a molecular weight of 405.48 g/mol. Its IUPAC name is 2-(2,6-dimethyl-4-oxo-1-pyridinyl)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide.

Molecular Properties

Compound Name2-(2,6-dimethyl-4-oxo-1-pyridinyl)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide
PubChem CID108806474
Molecular FormulaC19H23N3O5S
Molecular Weight405.48 g/mol
Exact Mass405.14
IUPAC Name2-(2,6-dimethyl-4-oxo-1-pyridinyl)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide
SMILESCc1cc(=O)cc(C)n1CC(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1
InChIInChI=1S/C19H23N3O5S/c1-14-11-17(23)12-15(2)22(14)13-19(24)20-16-3-5-18(6-4-16)28(25,26)21-7-9-27-10-8-21/h3-6,11-12H,7-10,13H2,1-2H3,(H,20,24)
InChIKeySYHYUYHVJNPXNN-UHFFFAOYSA-N
XLogP1.12
TPSA97.71 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.48
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethyl-4-oxo-1-pyridinyl)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide?
The IUPAC name of 2-(2,6-dimethyl-4-oxo-1-pyridinyl)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide (CID 108806474) is 2-(2,6-dimethyl-4-oxo-1-pyridinyl)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide.
What is the SMILES notation for 2-(2,6-dimethyl-4-oxo-1-pyridinyl)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide?
The canonical SMILES for 2-(2,6-dimethyl-4-oxo-1-pyridinyl)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide is Cc1cc(=O)cc(C)n1CC(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1.
What is the InChIKey of 2-(2,6-dimethyl-4-oxo-1-pyridinyl)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide?
The InChIKey is SYHYUYHVJNPXNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O5S/c1-14-11-17(23)12-15(2)22(14)13-19(24)20-16-3-5-18(6-4-16)28(25,26)21-7-9-27-10-8-21/h3-6,11-12H,7-10,13H2,1-2H3,(H,20,24).
What are the key properties of 2-(2,6-dimethyl-4-oxo-1-pyridinyl)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide?
2-(2,6-dimethyl-4-oxo-1-pyridinyl)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide has a molecular weight of 405.48 g/mol, XLogP of 1.12, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethyl-4-oxo-1-pyridinyl)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide is sourced from PubChem (CID 108806474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).