N-(2-cyclopentylethyl)-3-(ethylamino)pyridine-2-sulfonamide

C14H23N3O2S — CID 103304931

IUPACN-(2-cyclopentylethyl)-3-(ethylamino)pyridine-2-sulfonamide
SMILESCCNc1cccnc1S(=O)(=O)NCCC1CCCC1
InChIInChI=1S/C14H23N3O2S/c1-2-15-13-8-5-10-16-14(13)20(18,19)17-11-9-12-6-3-4-7-12/h5,8,10,12,15,17H,2-4,6-7,9,11H2,1H3
InChIKeyGFESRIHBYVGWMF-UHFFFAOYSA-N
MW297.42 g/mol
LogP2.37
Rot. Bonds7

About N-(2-cyclopentylethyl)-3-(ethylamino)pyridine-2-sulfonamide

N-(2-cyclopentylethyl)-3-(ethylamino)pyridine-2-sulfonamide (PubChem CID 103304931) has the molecular formula C14H23N3O2S and a molecular weight of 297.42 g/mol. Its IUPAC name is N-(2-cyclopentylethyl)-3-(ethylamino)pyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(2-cyclopentylethyl)-3-(ethylamino)pyridine-2-sulfonamide
PubChem CID103304931
Molecular FormulaC14H23N3O2S
Molecular Weight297.42 g/mol
Exact Mass297.15
IUPAC NameN-(2-cyclopentylethyl)-3-(ethylamino)pyridine-2-sulfonamide
SMILESCCNc1cccnc1S(=O)(=O)NCCC1CCCC1
InChIInChI=1S/C14H23N3O2S/c1-2-15-13-8-5-10-16-14(13)20(18,19)17-11-9-12-6-3-4-7-12/h5,8,10,12,15,17H,2-4,6-7,9,11H2,1H3
InChIKeyGFESRIHBYVGWMF-UHFFFAOYSA-N
XLogP2.37
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.42
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentylethyl)-3-(ethylamino)pyridine-2-sulfonamide?
The IUPAC name of N-(2-cyclopentylethyl)-3-(ethylamino)pyridine-2-sulfonamide (CID 103304931) is N-(2-cyclopentylethyl)-3-(ethylamino)pyridine-2-sulfonamide.
What is the SMILES notation for N-(2-cyclopentylethyl)-3-(ethylamino)pyridine-2-sulfonamide?
The canonical SMILES for N-(2-cyclopentylethyl)-3-(ethylamino)pyridine-2-sulfonamide is CCNc1cccnc1S(=O)(=O)NCCC1CCCC1.
What is the InChIKey of N-(2-cyclopentylethyl)-3-(ethylamino)pyridine-2-sulfonamide?
The InChIKey is GFESRIHBYVGWMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2S/c1-2-15-13-8-5-10-16-14(13)20(18,19)17-11-9-12-6-3-4-7-12/h5,8,10,12,15,17H,2-4,6-7,9,11H2,1H3.
What are the key properties of N-(2-cyclopentylethyl)-3-(ethylamino)pyridine-2-sulfonamide?
N-(2-cyclopentylethyl)-3-(ethylamino)pyridine-2-sulfonamide has a molecular weight of 297.42 g/mol, XLogP of 2.37, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentylethyl)-3-(ethylamino)pyridine-2-sulfonamide is sourced from PubChem (CID 103304931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).