N-[6-(2-ethylanilino)-3-pyridinyl]ethanesulfonamide

C15H19N3O2S — CID 113017407

IUPACN-[6-(2-ethylanilino)-3-pyridinyl]ethanesulfonamide
SMILESCCc1ccccc1Nc1ccc(NS(=O)(=O)CC)cn1
InChIInChI=1S/C15H19N3O2S/c1-3-12-7-5-6-8-14(12)17-15-10-9-13(11-16-15)18-21(19,20)4-2/h5-11,18H,3-4H2,1-2H3,(H,16,17)
InChIKeyRMMPXSNPOSHYAO-UHFFFAOYSA-N
MW305.40 g/mol
LogP3.15
Rot. Bonds6

About N-[6-(2-ethylanilino)-3-pyridinyl]ethanesulfonamide

N-[6-(2-ethylanilino)-3-pyridinyl]ethanesulfonamide (PubChem CID 113017407) has the molecular formula C15H19N3O2S and a molecular weight of 305.40 g/mol. Its IUPAC name is N-[6-(2-ethylanilino)-3-pyridinyl]ethanesulfonamide.

Molecular Properties

Compound NameN-[6-(2-ethylanilino)-3-pyridinyl]ethanesulfonamide
PubChem CID113017407
Molecular FormulaC15H19N3O2S
Molecular Weight305.40 g/mol
Exact Mass305.12
IUPAC NameN-[6-(2-ethylanilino)-3-pyridinyl]ethanesulfonamide
SMILESCCc1ccccc1Nc1ccc(NS(=O)(=O)CC)cn1
InChIInChI=1S/C15H19N3O2S/c1-3-12-7-5-6-8-14(12)17-15-10-9-13(11-16-15)18-21(19,20)4-2/h5-11,18H,3-4H2,1-2H3,(H,16,17)
InChIKeyRMMPXSNPOSHYAO-UHFFFAOYSA-N
XLogP3.15
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.40
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(2-ethylanilino)-3-pyridinyl]-3-phenylpropane-1-sulfonamide
CID 113017433
methyl 2-[[5-(ethylsulfonylamino)-2-pyridinyl]amino]benzoate
CID 113020650
1-[6-(2-ethylanilino)-3-pyridinyl]-3-phenylurea
CID 113017398
N-[6-(4-bromoanilino)-3-pyridinyl]ethanesulfonamide
CID 113019236
N-[6-(4-phenylmethoxyanilino)-3-pyridinyl]ethanesulfonamide
CID 113021250
N-[6-(2-ethylanilino)-3-pyridinyl]cyclobutanecarboxamide
CID 113017402
N-[6-(2-ethyl-6-methylanilino)-3-pyridinyl]butane-1-sulfonamide
CID 113017701
N-[6-(2-ethoxyanilino)-3-pyridinyl]benzenesulfonamide
CID 113019644
N-[6-(2-chloroanilino)-3-pyridinyl]-2-phenylethanesulfonamide
CID 113018483
N-(6-phenyl-3-pyridinyl)ethanesulfonamide
CID 110634770
N-[5-(2,6-diethylanilino)-2-pyridinyl]methanesulfonamide
CID 113032862
N-[6-(3-chloro-4-methoxyanilino)-3-pyridinyl]ethanesulfonamide
CID 113019129

Frequently Asked Questions

What is the IUPAC name of N-[6-(2-ethylanilino)-3-pyridinyl]ethanesulfonamide?
The IUPAC name of N-[6-(2-ethylanilino)-3-pyridinyl]ethanesulfonamide (CID 113017407) is N-[6-(2-ethylanilino)-3-pyridinyl]ethanesulfonamide.
What is the SMILES notation for N-[6-(2-ethylanilino)-3-pyridinyl]ethanesulfonamide?
The canonical SMILES for N-[6-(2-ethylanilino)-3-pyridinyl]ethanesulfonamide is CCc1ccccc1Nc1ccc(NS(=O)(=O)CC)cn1.
What is the InChIKey of N-[6-(2-ethylanilino)-3-pyridinyl]ethanesulfonamide?
The InChIKey is RMMPXSNPOSHYAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2S/c1-3-12-7-5-6-8-14(12)17-15-10-9-13(11-16-15)18-21(19,20)4-2/h5-11,18H,3-4H2,1-2H3,(H,16,17).
What are the key properties of N-[6-(2-ethylanilino)-3-pyridinyl]ethanesulfonamide?
N-[6-(2-ethylanilino)-3-pyridinyl]ethanesulfonamide has a molecular weight of 305.40 g/mol, XLogP of 3.15, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2-ethylanilino)-3-pyridinyl]ethanesulfonamide is sourced from PubChem (CID 113017407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).