(2S)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(2-ethylphenyl)propanamide

C17H18Cl2N2O3S — CID 124550207

IUPAC(2S)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(2-ethylphenyl)propanamide
SMILESCCc1ccccc1NC(=O)[C@H](C)NS(=O)(=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C17H18Cl2N2O3S/c1-3-12-6-4-5-7-15(12)20-17(22)11(2)21-25(23,24)16-10-13(18)8-9-14(16)19/h4-11,21H,3H2,1-2H3,(H,20,22)/t11-/m0/s1
InChIKeyHRRNFVHCMPZDOA-NSHDSACASA-N
MW401.32 g/mol
LogP3.86
Rot. Bonds6

About (2S)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(2-ethylphenyl)propanamide

(2S)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(2-ethylphenyl)propanamide (PubChem CID 124550207) has the molecular formula C17H18Cl2N2O3S and a molecular weight of 401.32 g/mol. Its IUPAC name is (2S)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(2-ethylphenyl)propanamide.

Molecular Properties

Compound Name(2S)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(2-ethylphenyl)propanamide
PubChem CID124550207
Molecular FormulaC17H18Cl2N2O3S
Molecular Weight401.32 g/mol
Exact Mass400.04
IUPAC Name(2S)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(2-ethylphenyl)propanamide
SMILESCCc1ccccc1NC(=O)[C@H](C)NS(=O)(=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C17H18Cl2N2O3S/c1-3-12-6-4-5-7-15(12)20-17(22)11(2)21-25(23,24)16-10-13(18)8-9-14(16)19/h4-11,21H,3H2,1-2H3,(H,20,22)/t11-/m0/s1
InChIKeyHRRNFVHCMPZDOA-NSHDSACASA-N
XLogP3.86
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.32
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2,5-dichlorophenyl)sulfonylamino]-N-(2,4-dimethylphenyl)propanamide
CID 5140094
(2R)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(2,6-dimethylphenyl)propanamide
CID 124549696
(2S)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(2-methyl-3-nitrophenyl)propanamide
CID 124551127
2,5-dichloro-N-(1-hydrazinyl-1-oxopropan-2-yl)benzenesulfonamide
CID 4320202
(2R)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(2-methoxy-5-methylphenyl)propanamide
CID 126398525
N-(2-ethylphenyl)-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide
CID 43890217
(2R)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide
CID 126394209
(2S)-2-[(5-chloro-2-methoxyphenyl)sulfonylamino]-N-(2-ethylphenyl)-3-phenylpropanamide
CID 28542619
(2R)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(3-ethoxypropyl)propanamide
CID 126397173
N-(2-ethylphenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide
CID 3256191
(2R)-N-(3-chloro-4-methoxyphenyl)-2-[(2,5-dichlorophenyl)sulfonylamino]propanamide
CID 126396716
2-[(2,5-dichlorophenyl)sulfonylamino]-N-(3-nitrophenyl)propanamide
CID 2969563

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(2-ethylphenyl)propanamide?
The IUPAC name of (2S)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(2-ethylphenyl)propanamide (CID 124550207) is (2S)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(2-ethylphenyl)propanamide.
What is the SMILES notation for (2S)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(2-ethylphenyl)propanamide?
The canonical SMILES for (2S)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(2-ethylphenyl)propanamide is CCc1ccccc1NC(=O)[C@H](C)NS(=O)(=O)c1cc(Cl)ccc1Cl.
What is the InChIKey of (2S)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(2-ethylphenyl)propanamide?
The InChIKey is HRRNFVHCMPZDOA-NSHDSACASA-N. The full InChI is InChI=1S/C17H18Cl2N2O3S/c1-3-12-6-4-5-7-15(12)20-17(22)11(2)21-25(23,24)16-10-13(18)8-9-14(16)19/h4-11,21H,3H2,1-2H3,(H,20,22)/t11-/m0/s1.
What are the key properties of (2S)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(2-ethylphenyl)propanamide?
(2S)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(2-ethylphenyl)propanamide has a molecular weight of 401.32 g/mol, XLogP of 3.86, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(2-ethylphenyl)propanamide is sourced from PubChem (CID 124550207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).