N-ethyl-2-(ethylamino)-N-(2-methylpropyl)pyridine-4-sulfonamide

C13H23N3O2S — CID 55044340

IUPACN-ethyl-2-(ethylamino)-N-(2-methylpropyl)pyridine-4-sulfonamide
SMILESCCNc1cc(S(=O)(=O)N(CC)CC(C)C)ccn1
InChIInChI=1S/C13H23N3O2S/c1-5-14-13-9-12(7-8-15-13)19(17,18)16(6-2)10-11(3)4/h7-9,11H,5-6,10H2,1-4H3,(H,14,15)
InChIKeyNTWFWODYIVGYMF-UHFFFAOYSA-N
MW285.41 g/mol
LogP2.18
Rot. Bonds7

About N-ethyl-2-(ethylamino)-N-(2-methylpropyl)pyridine-4-sulfonamide

N-ethyl-2-(ethylamino)-N-(2-methylpropyl)pyridine-4-sulfonamide (PubChem CID 55044340) has the molecular formula C13H23N3O2S and a molecular weight of 285.41 g/mol. Its IUPAC name is N-ethyl-2-(ethylamino)-N-(2-methylpropyl)pyridine-4-sulfonamide.

Molecular Properties

Compound NameN-ethyl-2-(ethylamino)-N-(2-methylpropyl)pyridine-4-sulfonamide
PubChem CID55044340
Molecular FormulaC13H23N3O2S
Molecular Weight285.41 g/mol
Exact Mass285.15
IUPAC NameN-ethyl-2-(ethylamino)-N-(2-methylpropyl)pyridine-4-sulfonamide
SMILESCCNc1cc(S(=O)(=O)N(CC)CC(C)C)ccn1
InChIInChI=1S/C13H23N3O2S/c1-5-14-13-9-12(7-8-15-13)19(17,18)16(6-2)10-11(3)4/h7-9,11H,5-6,10H2,1-4H3,(H,14,15)
InChIKeyNTWFWODYIVGYMF-UHFFFAOYSA-N
XLogP2.18
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.41
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,N-diethyl-2-(ethylamino)pyridine-4-sulfonamide
CID 62150008
2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-sulfonamide
CID 55043729
N-ethyl-N-(2-ethylbutyl)-2-hydrazinylpyridine-4-sulfonamide
CID 61437323
2-(ethylamino)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridine-4-sulfonamide
CID 62147964
2-(ethylamino)-N-propan-2-ylpyridine-4-sulfonamide
CID 62149834
N-(2,2-dimethylpropyl)-2-(ethylamino)-N-methylpyridine-4-sulfonamide
CID 62151680
N-ethyl-2-(methylamino)-N-propylpyridine-4-sulfonamide
CID 62144437
2-(ethylamino)-N-(3-ethylpentan-2-yl)pyridine-4-sulfonamide
CID 63838256
2-hydrazinyl-N-methyl-N-(2-methylpropyl)pyridine-4-sulfonamide
CID 61003232
N-ethyl-N-(2-methylpropyl)-6-(propylamino)pyridine-3-sulfonamide
CID 62143975
2-(ethylamino)-N-(4-fluorophenyl)-N-methylpyridine-4-sulfonamide
CID 62157688
2-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyridine-4-sulfonamide
CID 102907920

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(ethylamino)-N-(2-methylpropyl)pyridine-4-sulfonamide?
The IUPAC name of N-ethyl-2-(ethylamino)-N-(2-methylpropyl)pyridine-4-sulfonamide (CID 55044340) is N-ethyl-2-(ethylamino)-N-(2-methylpropyl)pyridine-4-sulfonamide.
What is the SMILES notation for N-ethyl-2-(ethylamino)-N-(2-methylpropyl)pyridine-4-sulfonamide?
The canonical SMILES for N-ethyl-2-(ethylamino)-N-(2-methylpropyl)pyridine-4-sulfonamide is CCNc1cc(S(=O)(=O)N(CC)CC(C)C)ccn1.
What is the InChIKey of N-ethyl-2-(ethylamino)-N-(2-methylpropyl)pyridine-4-sulfonamide?
The InChIKey is NTWFWODYIVGYMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2S/c1-5-14-13-9-12(7-8-15-13)19(17,18)16(6-2)10-11(3)4/h7-9,11H,5-6,10H2,1-4H3,(H,14,15).
What are the key properties of N-ethyl-2-(ethylamino)-N-(2-methylpropyl)pyridine-4-sulfonamide?
N-ethyl-2-(ethylamino)-N-(2-methylpropyl)pyridine-4-sulfonamide has a molecular weight of 285.41 g/mol, XLogP of 2.18, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(ethylamino)-N-(2-methylpropyl)pyridine-4-sulfonamide is sourced from PubChem (CID 55044340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).