N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]ethanesulfonamide

C15H17Cl2N3O2S — CID 113031073

IUPACN-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]ethanesulfonamide
SMILESCCS(=O)(=O)Nc1ccc(NCCc2ccc(Cl)cc2Cl)cn1
InChIInChI=1S/C15H17Cl2N3O2S/c1-2-23(21,22)20-15-6-5-13(10-19-15)18-8-7-11-3-4-12(16)9-14(11)17/h3-6,9-10,18H,2,7-8H2,1H3,(H,19,20)
InChIKeyWNQAHFILIIDXJD-UHFFFAOYSA-N
MW374.29 g/mol
LogP3.80
Rot. Bonds7

About N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]ethanesulfonamide

N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]ethanesulfonamide (PubChem CID 113031073) has the molecular formula C15H17Cl2N3O2S and a molecular weight of 374.29 g/mol. Its IUPAC name is N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]ethanesulfonamide.

Molecular Properties

Compound NameN-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]ethanesulfonamide
PubChem CID113031073
Molecular FormulaC15H17Cl2N3O2S
Molecular Weight374.29 g/mol
Exact Mass373.04
IUPAC NameN-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]ethanesulfonamide
SMILESCCS(=O)(=O)Nc1ccc(NCCc2ccc(Cl)cc2Cl)cn1
InChIInChI=1S/C15H17Cl2N3O2S/c1-2-23(21,22)20-15-6-5-13(10-19-15)18-8-7-11-3-4-12(16)9-14(11)17/h3-6,9-10,18H,2,7-8H2,1H3,(H,19,20)
InChIKeyWNQAHFILIIDXJD-UHFFFAOYSA-N
XLogP3.80
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.29
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-[2-(2,4-dichlorophenyl)ethylamino]-3-pyridinyl]propane-1-sulfonamide
CID 113015866
N-[4-[2-(2,4-dichlorophenyl)ethylamino]phenyl]propane-1-sulfonamide
CID 112985739
N-[5-(4-chloroanilino)-2-pyridinyl]ethanesulfonamide
CID 113033415
N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]cyclopropanecarboxamide
CID 113031057
N-(5-chloro-2-pyridinyl)ethanesulfonamide
CID 6486787
N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]furan-2-carboxamide
CID 113031062
N-[5-[3-(dimethylamino)propylamino]-2-pyridinyl]ethanesulfonamide
CID 113025774
5-[2-(2,4-dichlorophenyl)ethylamino]-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 109183900
5-[2-(2,4-dichlorophenyl)ethylamino]-N-(2-methylpropyl)pyridine-2-carboxamide
CID 109181090
N-[2-(2,4-dichlorophenyl)ethyl]-5-nitropyridin-2-amine
CID 28514790
5-[2-(2,4-dichlorophenyl)ethylamino]-N-[2-(dimethylamino)ethyl]pyridine-2-carboxamide
CID 109185349
N-[5-(3,4-dimethylanilino)-2-pyridinyl]ethanesulfonamide
CID 113032137

Frequently Asked Questions

What is the IUPAC name of N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]ethanesulfonamide?
The IUPAC name of N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]ethanesulfonamide (CID 113031073) is N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]ethanesulfonamide.
What is the SMILES notation for N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]ethanesulfonamide?
The canonical SMILES for N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]ethanesulfonamide is CCS(=O)(=O)Nc1ccc(NCCc2ccc(Cl)cc2Cl)cn1.
What is the InChIKey of N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]ethanesulfonamide?
The InChIKey is WNQAHFILIIDXJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17Cl2N3O2S/c1-2-23(21,22)20-15-6-5-13(10-19-15)18-8-7-11-3-4-12(16)9-14(11)17/h3-6,9-10,18H,2,7-8H2,1H3,(H,19,20).
What are the key properties of N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]ethanesulfonamide?
N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]ethanesulfonamide has a molecular weight of 374.29 g/mol, XLogP of 3.80, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]ethanesulfonamide is sourced from PubChem (CID 113031073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).