2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-sulfonamide

C13H23N3O2S — CID 55043729

IUPAC2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-sulfonamide
SMILESCCCN(C(C)C)S(=O)(=O)c1ccnc(NCC)c1
InChIInChI=1S/C13H23N3O2S/c1-5-9-16(11(3)4)19(17,18)12-7-8-15-13(10-12)14-6-2/h7-8,10-11H,5-6,9H2,1-4H3,(H,14,15)
InChIKeyWLMGDQHTCRYOOU-UHFFFAOYSA-N
MW285.41 g/mol
LogP2.32
Rot. Bonds7

About 2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-sulfonamide

2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-sulfonamide (PubChem CID 55043729) has the molecular formula C13H23N3O2S and a molecular weight of 285.41 g/mol. Its IUPAC name is 2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-sulfonamide.

Molecular Properties

Compound Name2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-sulfonamide
PubChem CID55043729
Molecular FormulaC13H23N3O2S
Molecular Weight285.41 g/mol
Exact Mass285.15
IUPAC Name2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-sulfonamide
SMILESCCCN(C(C)C)S(=O)(=O)c1ccnc(NCC)c1
InChIInChI=1S/C13H23N3O2S/c1-5-9-16(11(3)4)19(17,18)12-7-8-15-13(10-12)14-6-2/h7-8,10-11H,5-6,9H2,1-4H3,(H,14,15)
InChIKeyWLMGDQHTCRYOOU-UHFFFAOYSA-N
XLogP2.32
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 ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(ethylamino)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridine-4-sulfonamide
CID 62147964
N,N-diethyl-2-(ethylamino)pyridine-4-sulfonamide
CID 62150008
N-ethyl-2-(ethylamino)-N-(2-methylpropyl)pyridine-4-sulfonamide
CID 55044340
2-(ethylamino)-N-propan-2-ylpyridine-4-sulfonamide
CID 62149834
N-(2,2-dimethylpropyl)-2-(ethylamino)-N-methylpyridine-4-sulfonamide
CID 62151680
2-(ethylamino)-N-(3-ethylpentan-2-yl)pyridine-4-sulfonamide
CID 63838256
2-(ethylamino)-N-(4-fluorophenyl)-N-methylpyridine-4-sulfonamide
CID 62157688
N-ethyl-2-(methylamino)-N-propylpyridine-4-sulfonamide
CID 62144437
2-(ethylamino)-N-(3-ethylpentan-3-yl)pyridine-4-sulfonamide
CID 65042331
2-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyridine-4-sulfonamide
CID 102907920
N-(cyclohexylmethyl)-2-(ethylamino)-N-methylpyridine-4-sulfonamide
CID 62151719
N-ethyl-4-[[pentyl(propan-2-yl)amino]methyl]pyridin-2-amine
CID 62466441

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-sulfonamide?
The IUPAC name of 2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-sulfonamide (CID 55043729) is 2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-sulfonamide.
What is the SMILES notation for 2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-sulfonamide?
The canonical SMILES for 2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-sulfonamide is CCCN(C(C)C)S(=O)(=O)c1ccnc(NCC)c1.
What is the InChIKey of 2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-sulfonamide?
The InChIKey is WLMGDQHTCRYOOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2S/c1-5-9-16(11(3)4)19(17,18)12-7-8-15-13(10-12)14-6-2/h7-8,10-11H,5-6,9H2,1-4H3,(H,14,15).
What are the key properties of 2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-sulfonamide?
2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-sulfonamide has a molecular weight of 285.41 g/mol, XLogP of 2.32, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-sulfonamide is sourced from PubChem (CID 55043729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).