2-(ethylamino)-N-(4-methoxybutan-2-yl)pyridine-4-sulfonamide

C12H21N3O3S — CID 64605539

IUPAC2-(ethylamino)-N-(4-methoxybutan-2-yl)pyridine-4-sulfonamide
SMILESCCNc1cc(S(=O)(=O)NC(C)CCOC)ccn1
InChIInChI=1S/C12H21N3O3S/c1-4-13-12-9-11(5-7-14-12)19(16,17)15-10(2)6-8-18-3/h5,7,9-10,15H,4,6,8H2,1-3H3,(H,13,14)
InChIKeyBFGWISULZVSGIM-UHFFFAOYSA-N
MW287.39 g/mol
LogP1.22
Rot. Bonds8

About 2-(ethylamino)-N-(4-methoxybutan-2-yl)pyridine-4-sulfonamide

2-(ethylamino)-N-(4-methoxybutan-2-yl)pyridine-4-sulfonamide (PubChem CID 64605539) has the molecular formula C12H21N3O3S and a molecular weight of 287.39 g/mol. Its IUPAC name is 2-(ethylamino)-N-(4-methoxybutan-2-yl)pyridine-4-sulfonamide.

Molecular Properties

Compound Name2-(ethylamino)-N-(4-methoxybutan-2-yl)pyridine-4-sulfonamide
PubChem CID64605539
Molecular FormulaC12H21N3O3S
Molecular Weight287.39 g/mol
Exact Mass287.13
IUPAC Name2-(ethylamino)-N-(4-methoxybutan-2-yl)pyridine-4-sulfonamide
SMILESCCNc1cc(S(=O)(=O)NC(C)CCOC)ccn1
InChIInChI=1S/C12H21N3O3S/c1-4-13-12-9-11(5-7-14-12)19(16,17)15-10(2)6-8-18-3/h5,7,9-10,15H,4,6,8H2,1-3H3,(H,13,14)
InChIKeyBFGWISULZVSGIM-UHFFFAOYSA-N
XLogP1.22
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.39
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-hydrazinyl-N-(4-methoxybutan-2-yl)pyridine-4-sulfonamide
CID 64605294
2-(ethylamino)-N-propan-2-ylpyridine-4-sulfonamide
CID 62149834
N-(1-ethoxypropan-2-yl)-2-(ethylamino)pyridine-4-sulfonamide
CID 62158252
2-(ethylamino)-N-(3-ethylpentan-2-yl)pyridine-4-sulfonamide
CID 63838256
N-(1-cyclopropylpropan-2-yl)-2-(ethylamino)pyridine-4-sulfonamide
CID 63996785
2-(ethylamino)-N-(1-pyridin-2-ylethyl)pyridine-4-sulfonamide
CID 62146235
N-heptan-2-yl-2-(methylamino)pyridine-4-sulfonamide
CID 55043089
2-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyridine-4-sulfonamide
CID 102907920
2-(methylamino)-N-(6-methylheptan-2-yl)pyridine-4-sulfonamide
CID 62152785
2-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-4-sulfonamide
CID 62153288
2-(methylamino)-N-(4-methylpentan-2-yl)pyridine-4-sulfonamide
CID 55044390
2-chloro-N-(1-methoxypropan-2-yl)pyridine-4-sulfonamide
CID 61004005

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-(4-methoxybutan-2-yl)pyridine-4-sulfonamide?
The IUPAC name of 2-(ethylamino)-N-(4-methoxybutan-2-yl)pyridine-4-sulfonamide (CID 64605539) is 2-(ethylamino)-N-(4-methoxybutan-2-yl)pyridine-4-sulfonamide.
What is the SMILES notation for 2-(ethylamino)-N-(4-methoxybutan-2-yl)pyridine-4-sulfonamide?
The canonical SMILES for 2-(ethylamino)-N-(4-methoxybutan-2-yl)pyridine-4-sulfonamide is CCNc1cc(S(=O)(=O)NC(C)CCOC)ccn1.
What is the InChIKey of 2-(ethylamino)-N-(4-methoxybutan-2-yl)pyridine-4-sulfonamide?
The InChIKey is BFGWISULZVSGIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O3S/c1-4-13-12-9-11(5-7-14-12)19(16,17)15-10(2)6-8-18-3/h5,7,9-10,15H,4,6,8H2,1-3H3,(H,13,14).
What are the key properties of 2-(ethylamino)-N-(4-methoxybutan-2-yl)pyridine-4-sulfonamide?
2-(ethylamino)-N-(4-methoxybutan-2-yl)pyridine-4-sulfonamide has a molecular weight of 287.39 g/mol, XLogP of 1.22, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-(4-methoxybutan-2-yl)pyridine-4-sulfonamide is sourced from PubChem (CID 64605539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).