(2R)-2-amino-2-(4-phenoxyphenyl)sulfonylpropanamide

C15H16N2O4S — CID 154454459

IUPAC(2R)-2-amino-2-(4-phenoxyphenyl)sulfonylpropanamide
SMILESC[C@](N)(C(N)=O)S(=O)(=O)c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C15H16N2O4S/c1-15(17,14(16)18)22(19,20)13-9-7-12(8-10-13)21-11-5-3-2-4-6-11/h2-10H,17H2,1H3,(H2,16,18)/t15-/m1/s1
InChIKeyDIWIKXKIPUXNRS-OAHLLOKOSA-N
MW320.37 g/mol
LogP1.41
Rot. Bonds5

About (2R)-2-amino-2-(4-phenoxyphenyl)sulfonylpropanamide

(2R)-2-amino-2-(4-phenoxyphenyl)sulfonylpropanamide (PubChem CID 154454459) has the molecular formula C15H16N2O4S and a molecular weight of 320.37 g/mol. Its IUPAC name is (2R)-2-amino-2-(4-phenoxyphenyl)sulfonylpropanamide.

Molecular Properties

Compound Name(2R)-2-amino-2-(4-phenoxyphenyl)sulfonylpropanamide
PubChem CID154454459
Molecular FormulaC15H16N2O4S
Molecular Weight320.37 g/mol
Exact Mass320.08
IUPAC Name(2R)-2-amino-2-(4-phenoxyphenyl)sulfonylpropanamide
SMILESC[C@](N)(C(N)=O)S(=O)(=O)c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C15H16N2O4S/c1-15(17,14(16)18)22(19,20)13-9-7-12(8-10-13)21-11-5-3-2-4-6-11/h2-10H,17H2,1H3,(H2,16,18)/t15-/m1/s1
InChIKeyDIWIKXKIPUXNRS-OAHLLOKOSA-N
XLogP1.41
TPSA112.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.37
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-(4-phenoxyphenyl)sulfonylpropan-2-yl]thiirane
CID 44513270
2,2-diethyl-N'-(4-phenoxyphenyl)sulfonylpropanediamide
CID 68508410
2,2-difluoro-2-(4-phenoxyphenyl)sulfonyl-1-phenylethanol
CID 19804777
phenoxybenzene;propane-2,2-diol
CID 174556232
ethane;[4-(4-phenoxybenzoyl)phenyl]-(4-phenoxyphenyl)methanone
CID 142280871
1-[4-(benzenesulfonyl)phenoxy]-4-[(2-methylpropan-2-yl)oxy]benzene
CID 155030070
1-(benzenesulfonyl)-4-[4-[4-[4-(benzenesulfonyl)phenoxy]phenyl]sulfonylphenoxy]benzene
CID 175665287
azane;phenoxybenzene;sulfuric acid
CID 66973780
2-[(4-phenoxyphenyl)sulfonylamino]benzamide
CID 46763886
2-amino-N-hydroxy-3,3-dimethyl-4-(4-phenoxyphenyl)sulfonylbutanamide;hydrochloride
CID 18406833
3-[4-(trifluoromethylsulfonyl)phenoxy]aniline
CID 61027960
[3-[4-[4-(3-benzoylphenoxy)phenyl]sulfonylphenoxy]phenyl]-phenylmethanone
CID 175364339

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-2-(4-phenoxyphenyl)sulfonylpropanamide?
The IUPAC name of (2R)-2-amino-2-(4-phenoxyphenyl)sulfonylpropanamide (CID 154454459) is (2R)-2-amino-2-(4-phenoxyphenyl)sulfonylpropanamide.
What is the SMILES notation for (2R)-2-amino-2-(4-phenoxyphenyl)sulfonylpropanamide?
The canonical SMILES for (2R)-2-amino-2-(4-phenoxyphenyl)sulfonylpropanamide is C[C@](N)(C(N)=O)S(=O)(=O)c1ccc(Oc2ccccc2)cc1.
What is the InChIKey of (2R)-2-amino-2-(4-phenoxyphenyl)sulfonylpropanamide?
The InChIKey is DIWIKXKIPUXNRS-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H16N2O4S/c1-15(17,14(16)18)22(19,20)13-9-7-12(8-10-13)21-11-5-3-2-4-6-11/h2-10H,17H2,1H3,(H2,16,18)/t15-/m1/s1.
What are the key properties of (2R)-2-amino-2-(4-phenoxyphenyl)sulfonylpropanamide?
(2R)-2-amino-2-(4-phenoxyphenyl)sulfonylpropanamide has a molecular weight of 320.37 g/mol, XLogP of 1.41, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2-(4-phenoxyphenyl)sulfonylpropanamide is sourced from PubChem (CID 154454459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).