2-(ethylamino)-N-methyl-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide

C13H23N3O2S — CID 63960806

IUPAC2-(ethylamino)-N-methyl-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide
SMILESCCNc1ncccc1S(=O)(=O)N(C)C(C)(C)CC
InChIInChI=1S/C13H23N3O2S/c1-6-13(3,4)16(5)19(17,18)11-9-8-10-15-12(11)14-7-2/h8-10H,6-7H2,1-5H3,(H,14,15)
InChIKeySSEAOIKOZITFQA-UHFFFAOYSA-N
MW285.41 g/mol
LogP2.32
Rot. Bonds6

About 2-(ethylamino)-N-methyl-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide

2-(ethylamino)-N-methyl-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide (PubChem CID 63960806) has the molecular formula C13H23N3O2S and a molecular weight of 285.41 g/mol. Its IUPAC name is 2-(ethylamino)-N-methyl-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-(ethylamino)-N-methyl-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide
PubChem CID63960806
Molecular FormulaC13H23N3O2S
Molecular Weight285.41 g/mol
Exact Mass285.15
IUPAC Name2-(ethylamino)-N-methyl-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide
SMILESCCNc1ncccc1S(=O)(=O)N(C)C(C)(C)CC
InChIInChI=1S/C13H23N3O2S/c1-6-13(3,4)16(5)19(17,18)11-9-8-10-15-12(11)14-7-2/h8-10H,6-7H2,1-5H3,(H,14,15)
InChIKeySSEAOIKOZITFQA-UHFFFAOYSA-N
XLogP2.32
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.41
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-2-(ethylamino)-N-(2-hydroxy-2-methylpropyl)pyridine-3-sulfonamide
CID 79386192
N-(2,2-dimethylpropyl)-2-(ethylamino)pyridine-3-sulfonamide
CID 62147776
2-(ethylamino)-N-pyridin-4-ylpyridine-3-sulfonamide
CID 62143000
N-(cyclopropylmethyl)-2-(ethylamino)-N-propan-2-ylpyridine-3-sulfonamide
CID 62152949
N-methyl-N-propyl-2-(propylamino)pyridine-3-sulfonamide
CID 62144977
2-(ethylamino)-N-(2-methyl-3-pyridinyl)pyridine-3-sulfonamide
CID 79043589
N-methyl-N-(4-methylpentan-2-yl)-2-(propylamino)pyridine-3-sulfonamide
CID 62152933
2-(ethylamino)-N-pentylpyridine-3-sulfonamide
CID 62162989
5-bromo-N-methyl-N-(2-methylbutan-2-yl)-2-(propylamino)pyridine-3-sulfonamide
CID 63963344
N-(2-cyanophenyl)-2-(ethylamino)pyridine-3-sulfonamide
CID 62143298
N-[3-(diethylamino)propyl]-2-(ethylamino)pyridine-3-sulfonamide
CID 62143133
2-(ethylamino)-N-(2-methylcyclopropyl)pyridine-3-sulfonamide
CID 62410181

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-methyl-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide?
The IUPAC name of 2-(ethylamino)-N-methyl-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide (CID 63960806) is 2-(ethylamino)-N-methyl-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 2-(ethylamino)-N-methyl-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide?
The canonical SMILES for 2-(ethylamino)-N-methyl-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide is CCNc1ncccc1S(=O)(=O)N(C)C(C)(C)CC.
What is the InChIKey of 2-(ethylamino)-N-methyl-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide?
The InChIKey is SSEAOIKOZITFQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2S/c1-6-13(3,4)16(5)19(17,18)11-9-8-10-15-12(11)14-7-2/h8-10H,6-7H2,1-5H3,(H,14,15).
What are the key properties of 2-(ethylamino)-N-methyl-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide?
2-(ethylamino)-N-methyl-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide has a molecular weight of 285.41 g/mol, XLogP of 2.32, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-methyl-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 63960806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).