4-ethoxy-N-[1-(pyrazine-2-carbonyl)piperidin-4-yl]benzenesulfonamide

C18H22N4O4S — CID 108566859

IUPAC4-ethoxy-N-[1-(pyrazine-2-carbonyl)piperidin-4-yl]benzenesulfonamide
SMILESCCOc1ccc(S(=O)(=O)NC2CCN(C(=O)c3cnccn3)CC2)cc1
InChIInChI=1S/C18H22N4O4S/c1-2-26-15-3-5-16(6-4-15)27(24,25)21-14-7-11-22(12-8-14)18(23)17-13-19-9-10-20-17/h3-6,9-10,13-14,21H,2,7-8,11-12H2,1H3
InChIKeyQVJJLULIMBDXDR-UHFFFAOYSA-N
MW390.47 g/mol
LogP1.46
Rot. Bonds6

About 4-ethoxy-N-[1-(pyrazine-2-carbonyl)piperidin-4-yl]benzenesulfonamide

4-ethoxy-N-[1-(pyrazine-2-carbonyl)piperidin-4-yl]benzenesulfonamide (PubChem CID 108566859) has the molecular formula C18H22N4O4S and a molecular weight of 390.47 g/mol. Its IUPAC name is 4-ethoxy-N-[1-(pyrazine-2-carbonyl)piperidin-4-yl]benzenesulfonamide.

Molecular Properties

Compound Name4-ethoxy-N-[1-(pyrazine-2-carbonyl)piperidin-4-yl]benzenesulfonamide
PubChem CID108566859
Molecular FormulaC18H22N4O4S
Molecular Weight390.47 g/mol
Exact Mass390.14
IUPAC Name4-ethoxy-N-[1-(pyrazine-2-carbonyl)piperidin-4-yl]benzenesulfonamide
SMILESCCOc1ccc(S(=O)(=O)NC2CCN(C(=O)c3cnccn3)CC2)cc1
InChIInChI=1S/C18H22N4O4S/c1-2-26-15-3-5-16(6-4-15)27(24,25)21-14-7-11-22(12-8-14)18(23)17-13-19-9-10-20-17/h3-6,9-10,13-14,21H,2,7-8,11-12H2,1H3
InChIKeyQVJJLULIMBDXDR-UHFFFAOYSA-N
XLogP1.46
TPSA101.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.47
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-tert-butyl-N-[1-(pyrazine-2-carbonyl)piperidin-4-yl]benzenesulfonamide
CID 108566849
N-[4-[[1-(pyrazine-2-carbonyl)piperidin-4-yl]sulfamoyl]phenyl]acetamide
CID 108566860
N-[1-(4-ethoxybenzoyl)piperidin-4-yl]-4-methylbenzenesulfonamide
CID 17497600
4-ethoxy-N-[1-(2-methylpropanoyl)piperidin-4-yl]benzenesulfonamide
CID 35402103
N-[1-(3,4-dimethoxybenzoyl)piperidin-4-yl]-4-ethoxybenzenesulfonamide
CID 108563446
4-ethoxy-N-(1-ethylpiperidin-4-yl)benzenesulfonamide
CID 22772564
4-chloro-N-[1-[2-(4-ethoxyphenyl)acetyl]piperidin-4-yl]benzenesulfonamide
CID 108565571
[4-[[(1R)-1-(2-hydroxyphenyl)propyl]amino]piperidin-1-yl]-pyrazin-2-ylmethanone
CID 99702778
3,5-dimethyl-N-[1-(pyrazine-2-carbonyl)piperidin-4-yl]-1H-pyrazole-4-sulfonamide
CID 108566855
4-methoxy-N-[1-(pyrazine-2-carbonyl)piperidin-4-yl]benzamide
CID 110821265
[4-[(4-methoxycyclohexyl)amino]piperidin-1-yl]-pyrazin-2-ylmethanone
CID 165419586
3,4,5-triethoxy-N-[1-(pyrazine-2-carbonyl)piperidin-4-yl]benzamide
CID 108550660

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-[1-(pyrazine-2-carbonyl)piperidin-4-yl]benzenesulfonamide?
The IUPAC name of 4-ethoxy-N-[1-(pyrazine-2-carbonyl)piperidin-4-yl]benzenesulfonamide (CID 108566859) is 4-ethoxy-N-[1-(pyrazine-2-carbonyl)piperidin-4-yl]benzenesulfonamide.
What is the SMILES notation for 4-ethoxy-N-[1-(pyrazine-2-carbonyl)piperidin-4-yl]benzenesulfonamide?
The canonical SMILES for 4-ethoxy-N-[1-(pyrazine-2-carbonyl)piperidin-4-yl]benzenesulfonamide is CCOc1ccc(S(=O)(=O)NC2CCN(C(=O)c3cnccn3)CC2)cc1.
What is the InChIKey of 4-ethoxy-N-[1-(pyrazine-2-carbonyl)piperidin-4-yl]benzenesulfonamide?
The InChIKey is QVJJLULIMBDXDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O4S/c1-2-26-15-3-5-16(6-4-15)27(24,25)21-14-7-11-22(12-8-14)18(23)17-13-19-9-10-20-17/h3-6,9-10,13-14,21H,2,7-8,11-12H2,1H3.
What are the key properties of 4-ethoxy-N-[1-(pyrazine-2-carbonyl)piperidin-4-yl]benzenesulfonamide?
4-ethoxy-N-[1-(pyrazine-2-carbonyl)piperidin-4-yl]benzenesulfonamide has a molecular weight of 390.47 g/mol, XLogP of 1.46, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-[1-(pyrazine-2-carbonyl)piperidin-4-yl]benzenesulfonamide is sourced from PubChem (CID 108566859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).