2-methoxy-2-phenyl-N-(pyridin-2-ylmethylsulfonyl)acetamide

C15H16N2O4S — CID 167984020

IUPAC2-methoxy-2-phenyl-N-(pyridin-2-ylmethylsulfonyl)acetamide
SMILESCOC(C(=O)NS(=O)(=O)Cc1ccccn1)c1ccccc1
InChIInChI=1S/C15H16N2O4S/c1-21-14(12-7-3-2-4-8-12)15(18)17-22(19,20)11-13-9-5-6-10-16-13/h2-10,14H,11H2,1H3,(H,17,18)
InChIKeyPRBSAGZSHQCHKC-UHFFFAOYSA-N
MW320.37 g/mol
LogP1.42
Rot. Bonds6

About 2-methoxy-2-phenyl-N-(pyridin-2-ylmethylsulfonyl)acetamide

2-methoxy-2-phenyl-N-(pyridin-2-ylmethylsulfonyl)acetamide (PubChem CID 167984020) has the molecular formula C15H16N2O4S and a molecular weight of 320.37 g/mol. Its IUPAC name is 2-methoxy-2-phenyl-N-(pyridin-2-ylmethylsulfonyl)acetamide.

Molecular Properties

Compound Name2-methoxy-2-phenyl-N-(pyridin-2-ylmethylsulfonyl)acetamide
PubChem CID167984020
Molecular FormulaC15H16N2O4S
Molecular Weight320.37 g/mol
Exact Mass320.08
IUPAC Name2-methoxy-2-phenyl-N-(pyridin-2-ylmethylsulfonyl)acetamide
SMILESCOC(C(=O)NS(=O)(=O)Cc1ccccn1)c1ccccc1
InChIInChI=1S/C15H16N2O4S/c1-21-14(12-7-3-2-4-8-12)15(18)17-22(19,20)11-13-9-5-6-10-16-13/h2-10,14H,11H2,1H3,(H,17,18)
InChIKeyPRBSAGZSHQCHKC-UHFFFAOYSA-N
XLogP1.42
TPSA85.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.37
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-3-hydroxy-2-[(2-methoxy-2-phenylacetyl)amino]propanoic acid
CID 80750625
acetic acid;2-(methylsulfonylmethyl)pyridine
CID 174445775
(2R)-2-methoxy-2-phenyl-N-pyridin-3-ylsulfonylacetamide
CID 95301779
N-hydroxy-2-methoxy-2-phenylacetamide
CID 14200442
(2R)-2-[(2-methoxy-2-phenylacetyl)amino]-3-sulfopropanoic acid
CID 89123823
N-(2-chloro-3-pyridinyl)-2-methoxy-2-phenylacetamide
CID 75846276
(2S)-2-[(2-methoxy-2-phenylacetyl)amino]propanoic acid
CID 78986376
(2R)-3-[[(2S)-2-methoxy-2-phenylacetyl]amino]-2-phenylpropanoic acid
CID 124724861
methyl 2-phenyl-2-(pyridin-2-ylmethylamino)acetate
CID 60647783
(1S,5R)-6,6-dimethyl-N-(pyridin-2-ylmethylsulfonyl)bicyclo[3.1.0]hexane-3-carboxamide
CID 166268779
(2S)-2-[methyl(methylsulfonyl)amino]-2-phenyl-N-(pyridin-2-ylmethyl)acetamide
CID 125054382
4-[[(2R)-2-methoxy-2-phenylacetyl]sulfamoyl]benzamide
CID 95300549

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-2-phenyl-N-(pyridin-2-ylmethylsulfonyl)acetamide?
The IUPAC name of 2-methoxy-2-phenyl-N-(pyridin-2-ylmethylsulfonyl)acetamide (CID 167984020) is 2-methoxy-2-phenyl-N-(pyridin-2-ylmethylsulfonyl)acetamide.
What is the SMILES notation for 2-methoxy-2-phenyl-N-(pyridin-2-ylmethylsulfonyl)acetamide?
The canonical SMILES for 2-methoxy-2-phenyl-N-(pyridin-2-ylmethylsulfonyl)acetamide is COC(C(=O)NS(=O)(=O)Cc1ccccn1)c1ccccc1.
What is the InChIKey of 2-methoxy-2-phenyl-N-(pyridin-2-ylmethylsulfonyl)acetamide?
The InChIKey is PRBSAGZSHQCHKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O4S/c1-21-14(12-7-3-2-4-8-12)15(18)17-22(19,20)11-13-9-5-6-10-16-13/h2-10,14H,11H2,1H3,(H,17,18).
What are the key properties of 2-methoxy-2-phenyl-N-(pyridin-2-ylmethylsulfonyl)acetamide?
2-methoxy-2-phenyl-N-(pyridin-2-ylmethylsulfonyl)acetamide has a molecular weight of 320.37 g/mol, XLogP of 1.42, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-2-phenyl-N-(pyridin-2-ylmethylsulfonyl)acetamide is sourced from PubChem (CID 167984020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).