(2R)-2-methoxy-2-phenyl-N-pyridin-3-ylsulfonylacetamide

C14H14N2O4S — CID 95301779

IUPAC(2R)-2-methoxy-2-phenyl-N-pyridin-3-ylsulfonylacetamide
SMILESCO[C@@H](C(=O)NS(=O)(=O)c1cccnc1)c1ccccc1
InChIInChI=1S/C14H14N2O4S/c1-20-13(11-6-3-2-4-7-11)14(17)16-21(18,19)12-8-5-9-15-10-12/h2-10,13H,1H3,(H,16,17)/t13-/m1/s1
InChIKeyPGQGSGLKSMHIOP-CYBMUJFWSA-N
MW306.34 g/mol
LogP1.27
Rot. Bonds5

About (2R)-2-methoxy-2-phenyl-N-pyridin-3-ylsulfonylacetamide

(2R)-2-methoxy-2-phenyl-N-pyridin-3-ylsulfonylacetamide (PubChem CID 95301779) has the molecular formula C14H14N2O4S and a molecular weight of 306.34 g/mol. Its IUPAC name is (2R)-2-methoxy-2-phenyl-N-pyridin-3-ylsulfonylacetamide.

Molecular Properties

Compound Name(2R)-2-methoxy-2-phenyl-N-pyridin-3-ylsulfonylacetamide
PubChem CID95301779
Molecular FormulaC14H14N2O4S
Molecular Weight306.34 g/mol
Exact Mass306.07
IUPAC Name(2R)-2-methoxy-2-phenyl-N-pyridin-3-ylsulfonylacetamide
SMILESCO[C@@H](C(=O)NS(=O)(=O)c1cccnc1)c1ccccc1
InChIInChI=1S/C14H14N2O4S/c1-20-13(11-6-3-2-4-7-11)14(17)16-21(18,19)12-8-5-9-15-10-12/h2-10,13H,1H3,(H,16,17)/t13-/m1/s1
InChIKeyPGQGSGLKSMHIOP-CYBMUJFWSA-N
XLogP1.27
TPSA85.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.34
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-methoxy-2-phenyl-N-pyridin-3-ylsulfonylacetamide?
The IUPAC name of (2R)-2-methoxy-2-phenyl-N-pyridin-3-ylsulfonylacetamide (CID 95301779) is (2R)-2-methoxy-2-phenyl-N-pyridin-3-ylsulfonylacetamide.
What is the SMILES notation for (2R)-2-methoxy-2-phenyl-N-pyridin-3-ylsulfonylacetamide?
The canonical SMILES for (2R)-2-methoxy-2-phenyl-N-pyridin-3-ylsulfonylacetamide is CO[C@@H](C(=O)NS(=O)(=O)c1cccnc1)c1ccccc1.
What is the InChIKey of (2R)-2-methoxy-2-phenyl-N-pyridin-3-ylsulfonylacetamide?
The InChIKey is PGQGSGLKSMHIOP-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H14N2O4S/c1-20-13(11-6-3-2-4-7-11)14(17)16-21(18,19)12-8-5-9-15-10-12/h2-10,13H,1H3,(H,16,17)/t13-/m1/s1.
What are the key properties of (2R)-2-methoxy-2-phenyl-N-pyridin-3-ylsulfonylacetamide?
(2R)-2-methoxy-2-phenyl-N-pyridin-3-ylsulfonylacetamide has a molecular weight of 306.34 g/mol, XLogP of 1.27, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methoxy-2-phenyl-N-pyridin-3-ylsulfonylacetamide is sourced from PubChem (CID 95301779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).