(2R)-2-phenylmethoxy-N-pyridin-3-ylsulfonylpropanamide

C15H16N2O4S — CID 94189477

IUPAC(2R)-2-phenylmethoxy-N-pyridin-3-ylsulfonylpropanamide
SMILESC[C@@H](OCc1ccccc1)C(=O)NS(=O)(=O)c1cccnc1
InChIInChI=1S/C15H16N2O4S/c1-12(21-11-13-6-3-2-4-7-13)15(18)17-22(19,20)14-8-5-9-16-10-14/h2-10,12H,11H2,1H3,(H,17,18)/t12-/m1/s1
InChIKeyYSOBZEBVNCLLKW-GFCCVEGCSA-N
MW320.37 g/mol
LogP1.49
Rot. Bonds6

About (2R)-2-phenylmethoxy-N-pyridin-3-ylsulfonylpropanamide

(2R)-2-phenylmethoxy-N-pyridin-3-ylsulfonylpropanamide (PubChem CID 94189477) has the molecular formula C15H16N2O4S and a molecular weight of 320.37 g/mol. Its IUPAC name is (2R)-2-phenylmethoxy-N-pyridin-3-ylsulfonylpropanamide.

Molecular Properties

Compound Name(2R)-2-phenylmethoxy-N-pyridin-3-ylsulfonylpropanamide
PubChem CID94189477
Molecular FormulaC15H16N2O4S
Molecular Weight320.37 g/mol
Exact Mass320.08
IUPAC Name(2R)-2-phenylmethoxy-N-pyridin-3-ylsulfonylpropanamide
SMILESC[C@@H](OCc1ccccc1)C(=O)NS(=O)(=O)c1cccnc1
InChIInChI=1S/C15H16N2O4S/c1-12(21-11-13-6-3-2-4-7-13)15(18)17-22(19,20)14-8-5-9-16-10-14/h2-10,12H,11H2,1H3,(H,17,18)/t12-/m1/s1
InChIKeyYSOBZEBVNCLLKW-GFCCVEGCSA-N
XLogP1.49
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 ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-3-phenyl-N-pyridin-3-ylsulfonylpropanamide
CID 59892161
2-phenylmethoxy-N-(pyridin-3-ylmethyl)propanamide
CID 42959352
2-cycloheptyloxy-N-pyridin-3-ylsulfonylpropanamide
CID 91644611
(2R)-2-methoxy-2-phenyl-N-pyridin-3-ylsulfonylacetamide
CID 95301779
(2S)-2-phenyl-N-pyridin-3-ylsulfonyl-2-(2,2,2-trifluoroethoxy)acetamide
CID 99646668
(2R)-2-(3-methyl-4-propan-2-ylphenoxy)-N-pyridin-3-ylsulfonylpropanamide
CID 94189479
N-[2-(methanesulfonamido)ethyl]-2-phenylmethoxypropanamide
CID 47028889
N-(2-phenylethenylsulfonyl)-2-phenylmethoxypropanamide
CID 103598013
2-(pyridin-3-ylsulfonylamino)propanoic acid
CID 24691769
3-methyl-2-(2-phenylmethoxypropanoylamino)butanoic acid
CID 43354070
(2S)-2-ethoxy-N-(4-phenylphenyl)sulfonylpropanamide
CID 96524563
(2S)-2-[[(2S)-2-phenylmethoxypropanoyl]amino]propanoic acid
CID 10777126

Frequently Asked Questions

What is the IUPAC name of (2R)-2-phenylmethoxy-N-pyridin-3-ylsulfonylpropanamide?
The IUPAC name of (2R)-2-phenylmethoxy-N-pyridin-3-ylsulfonylpropanamide (CID 94189477) is (2R)-2-phenylmethoxy-N-pyridin-3-ylsulfonylpropanamide.
What is the SMILES notation for (2R)-2-phenylmethoxy-N-pyridin-3-ylsulfonylpropanamide?
The canonical SMILES for (2R)-2-phenylmethoxy-N-pyridin-3-ylsulfonylpropanamide is C[C@@H](OCc1ccccc1)C(=O)NS(=O)(=O)c1cccnc1.
What is the InChIKey of (2R)-2-phenylmethoxy-N-pyridin-3-ylsulfonylpropanamide?
The InChIKey is YSOBZEBVNCLLKW-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H16N2O4S/c1-12(21-11-13-6-3-2-4-7-13)15(18)17-22(19,20)14-8-5-9-16-10-14/h2-10,12H,11H2,1H3,(H,17,18)/t12-/m1/s1.
What are the key properties of (2R)-2-phenylmethoxy-N-pyridin-3-ylsulfonylpropanamide?
(2R)-2-phenylmethoxy-N-pyridin-3-ylsulfonylpropanamide has a molecular weight of 320.37 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 (2R)-2-phenylmethoxy-N-pyridin-3-ylsulfonylpropanamide is sourced from PubChem (CID 94189477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).