2-(2-methoxy-N-methylsulfonylanilino)-N-pyridin-3-ylacetamide

C15H17N3O4S — CID 700335

IUPAC2-(2-methoxy-N-methylsulfonylanilino)-N-pyridin-3-ylacetamide
SMILESCOc1ccccc1N(CC(=O)Nc1cccnc1)S(C)(=O)=O
InChIInChI=1S/C15H17N3O4S/c1-22-14-8-4-3-7-13(14)18(23(2,20)21)11-15(19)17-12-6-5-9-16-10-12/h3-10H,11H2,1-2H3,(H,17,19)
InChIKeyBHUKACUCKLCZND-UHFFFAOYSA-N
MW335.39 g/mol
LogP1.49
Rot. Bonds6

About 2-(2-methoxy-N-methylsulfonylanilino)-N-pyridin-3-ylacetamide

2-(2-methoxy-N-methylsulfonylanilino)-N-pyridin-3-ylacetamide (PubChem CID 700335) has the molecular formula C15H17N3O4S and a molecular weight of 335.39 g/mol. Its IUPAC name is 2-(2-methoxy-N-methylsulfonylanilino)-N-pyridin-3-ylacetamide.

Molecular Properties

Compound Name2-(2-methoxy-N-methylsulfonylanilino)-N-pyridin-3-ylacetamide
PubChem CID700335
Molecular FormulaC15H17N3O4S
Molecular Weight335.39 g/mol
Exact Mass335.09
IUPAC Name2-(2-methoxy-N-methylsulfonylanilino)-N-pyridin-3-ylacetamide
SMILESCOc1ccccc1N(CC(=O)Nc1cccnc1)S(C)(=O)=O
InChIInChI=1S/C15H17N3O4S/c1-22-14-8-4-3-7-13(14)18(23(2,20)21)11-15(19)17-12-6-5-9-16-10-12/h3-10H,11H2,1-2H3,(H,17,19)
InChIKeyBHUKACUCKLCZND-UHFFFAOYSA-N
XLogP1.49
TPSA88.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.39
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-hydroxy-2-[(4-methoxybenzene)(pyridin-2-ylmethyl)sulfonamido]acetamide
CID 10760373
N-(2-methoxyphenyl)-N'-pyridin-2-yloxamide
CID 2907831
2-[Benzenesulfonyl-(2-methoxy-phenyl)-amino]-N-pyridin-3-yl-acetamide
CID 1139748
2-[(2,5-Dimethoxy-phenyl)-methanesulfonyl-amino]-N-pyridin-3-yl-acetamide
CID 1145331
4-Methoxy-N-pyridin-3-yl-benzenesulfonamide
CID 771985
2-Phenoxy-N-(3-pyridinyl)acetamide
CID 309156
2-(2-methoxy-N-methylsulfonylanilino)-N-(pyridin-2-ylmethyl)acetamide
CID 700541
N~2~-(3-methoxyphenyl)-N~2~-(methylsulfonyl)-N~1~-(3-pyridinylmethyl)glycinamide
CID 815951
2-(2-ethoxy-N-methylsulfonylanilino)-N-pyridin-3-ylacetamide
CID 816069
2-{[(4-ethoxyphenyl)sulfonyl]phenylamino}-N-(3-pyridyl)acetamide
CID 1084914
Cambridge id 6392977
CID 1137097
2-[Benzenesulfonyl-(2-methoxy-phenyl)-amino]-N-(4-pyridin-4-ylmethyl-phenyl)-acetamide
CID 1166448

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxy-N-methylsulfonylanilino)-N-pyridin-3-ylacetamide?
The IUPAC name of 2-(2-methoxy-N-methylsulfonylanilino)-N-pyridin-3-ylacetamide (CID 700335) is 2-(2-methoxy-N-methylsulfonylanilino)-N-pyridin-3-ylacetamide.
What is the SMILES notation for 2-(2-methoxy-N-methylsulfonylanilino)-N-pyridin-3-ylacetamide?
The canonical SMILES for 2-(2-methoxy-N-methylsulfonylanilino)-N-pyridin-3-ylacetamide is COc1ccccc1N(CC(=O)Nc1cccnc1)S(C)(=O)=O.
What is the InChIKey of 2-(2-methoxy-N-methylsulfonylanilino)-N-pyridin-3-ylacetamide?
The InChIKey is BHUKACUCKLCZND-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O4S/c1-22-14-8-4-3-7-13(14)18(23(2,20)21)11-15(19)17-12-6-5-9-16-10-12/h3-10H,11H2,1-2H3,(H,17,19).
What are the key properties of 2-(2-methoxy-N-methylsulfonylanilino)-N-pyridin-3-ylacetamide?
2-(2-methoxy-N-methylsulfonylanilino)-N-pyridin-3-ylacetamide has a molecular weight of 335.39 g/mol, XLogP of 1.49, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxy-N-methylsulfonylanilino)-N-pyridin-3-ylacetamide is sourced from PubChem (CID 700335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).