(2R)-3-(benzenesulfonyl)-N-(2,4-dichlorophenyl)-2-hydroxy-2-methylpropanamide

C16H15Cl2NO4S — CID 1476452

IUPAC(2R)-3-(benzenesulfonyl)-N-(2,4-dichlorophenyl)-2-hydroxy-2-methylpropanamide
SMILESC[C@](O)(CS(=O)(=O)c1ccccc1)C(=O)Nc1ccc(Cl)cc1Cl
InChIInChI=1S/C16H15Cl2NO4S/c1-16(21,10-24(22,23)12-5-3-2-4-6-12)15(20)19-14-8-7-11(17)9-13(14)18/h2-9,21H,10H2,1H3,(H,19,20)/t16-/m0/s1
InChIKeyZXNFULOHXKMJFY-INIZCTEOSA-N
MW388.27 g/mol
LogP3.16
Rot. Bonds5

About (2R)-3-(benzenesulfonyl)-N-(2,4-dichlorophenyl)-2-hydroxy-2-methylpropanamide

(2R)-3-(benzenesulfonyl)-N-(2,4-dichlorophenyl)-2-hydroxy-2-methylpropanamide (PubChem CID 1476452) has the molecular formula C16H15Cl2NO4S and a molecular weight of 388.27 g/mol. Its IUPAC name is (2R)-3-(benzenesulfonyl)-N-(2,4-dichlorophenyl)-2-hydroxy-2-methylpropanamide.

Molecular Properties

Compound Name(2R)-3-(benzenesulfonyl)-N-(2,4-dichlorophenyl)-2-hydroxy-2-methylpropanamide
PubChem CID1476452
Molecular FormulaC16H15Cl2NO4S
Molecular Weight388.27 g/mol
Exact Mass387.01
IUPAC Name(2R)-3-(benzenesulfonyl)-N-(2,4-dichlorophenyl)-2-hydroxy-2-methylpropanamide
SMILESC[C@](O)(CS(=O)(=O)c1ccccc1)C(=O)Nc1ccc(Cl)cc1Cl
InChIInChI=1S/C16H15Cl2NO4S/c1-16(21,10-24(22,23)12-5-3-2-4-6-12)15(20)19-14-8-7-11(17)9-13(14)18/h2-9,21H,10H2,1H3,(H,19,20)/t16-/m0/s1
InChIKeyZXNFULOHXKMJFY-INIZCTEOSA-N
XLogP3.16
TPSA83.47 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.27
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-3-benzylsulfonyl-N-(2,4-dichlorophenyl)-2-hydroxy-2-methylpropanamide
CID 1476456
(2S)-N-(4-chlorophenyl)-3-(3-chlorophenyl)sulfonyl-2-hydroxy-2-methylpropanamide
CID 1476404
N-(2-chlorophenyl)-N'-(2,4-dichlorophenyl)-2,2-dimethylpropanediamide
CID 108968895
2,2-dichloro-N-(2,4-dichlorophenyl)propanamide
CID 521736
N-(2,4-dichlorophenyl)-2,2-dimethyl-N'-(2-phenylethyl)propanediamide
CID 108963909
N,N'-bis(2,4-dichlorophenyl)-2,2-dimethylpentanediamide
CID 6610958
3-(4-chlorophenyl)sulfonyl-N-(2,4-dichlorophenyl)propanamide
CID 26589989
N-[4-(benzenesulfonamido)-2-chlorophenyl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide
CID 22287185
N-(2,4-dichlorophenyl)-3,3-dimethylbutanamide
CID 884679
2-(benzenesulfonamido)-N-(2,4-dichlorophenyl)benzamide
CID 155547933
N-(2-cyanophenyl)-N'-(2,4-dichlorophenyl)-2,2-dimethylpropanediamide
CID 108970103
N-[1-(2,4-dichloroanilino)-1-oxo-3-phenylpropan-2-yl]-2,2-dimethylpropanamide
CID 42725016

Frequently Asked Questions

What is the IUPAC name of (2R)-3-(benzenesulfonyl)-N-(2,4-dichlorophenyl)-2-hydroxy-2-methylpropanamide?
The IUPAC name of (2R)-3-(benzenesulfonyl)-N-(2,4-dichlorophenyl)-2-hydroxy-2-methylpropanamide (CID 1476452) is (2R)-3-(benzenesulfonyl)-N-(2,4-dichlorophenyl)-2-hydroxy-2-methylpropanamide.
What is the SMILES notation for (2R)-3-(benzenesulfonyl)-N-(2,4-dichlorophenyl)-2-hydroxy-2-methylpropanamide?
The canonical SMILES for (2R)-3-(benzenesulfonyl)-N-(2,4-dichlorophenyl)-2-hydroxy-2-methylpropanamide is C[C@](O)(CS(=O)(=O)c1ccccc1)C(=O)Nc1ccc(Cl)cc1Cl.
What is the InChIKey of (2R)-3-(benzenesulfonyl)-N-(2,4-dichlorophenyl)-2-hydroxy-2-methylpropanamide?
The InChIKey is ZXNFULOHXKMJFY-INIZCTEOSA-N. The full InChI is InChI=1S/C16H15Cl2NO4S/c1-16(21,10-24(22,23)12-5-3-2-4-6-12)15(20)19-14-8-7-11(17)9-13(14)18/h2-9,21H,10H2,1H3,(H,19,20)/t16-/m0/s1.
What are the key properties of (2R)-3-(benzenesulfonyl)-N-(2,4-dichlorophenyl)-2-hydroxy-2-methylpropanamide?
(2R)-3-(benzenesulfonyl)-N-(2,4-dichlorophenyl)-2-hydroxy-2-methylpropanamide has a molecular weight of 388.27 g/mol, XLogP of 3.16, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-3-(benzenesulfonyl)-N-(2,4-dichlorophenyl)-2-hydroxy-2-methylpropanamide is sourced from PubChem (CID 1476452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).