2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-3-carboxamide

C16H19N3O4S — CID 2084510

IUPAC2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-3-carboxamide
SMILESCCOc1ncccc1C(=O)NCCc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C16H19N3O4S/c1-2-23-16-14(4-3-10-19-16)15(20)18-11-9-12-5-7-13(8-6-12)24(17,21)22/h3-8,10H,2,9,11H2,1H3,(H,18,20)(H2,17,21,22)
InChIKeyFOJNUROFSDPLEH-UHFFFAOYSA-N
MW349.41 g/mol
LogP1.10
Rot. Bonds7

About 2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-3-carboxamide

2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-3-carboxamide (PubChem CID 2084510) has the molecular formula C16H19N3O4S and a molecular weight of 349.41 g/mol. Its IUPAC name is 2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-3-carboxamide
PubChem CID2084510
Molecular FormulaC16H19N3O4S
Molecular Weight349.41 g/mol
Exact Mass349.11
IUPAC Name2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-3-carboxamide
SMILESCCOc1ncccc1C(=O)NCCc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C16H19N3O4S/c1-2-23-16-14(4-3-10-19-16)15(20)18-11-9-12-5-7-13(8-6-12)24(17,21)22/h3-8,10H,2,9,11H2,1H3,(H,18,20)(H2,17,21,22)
InChIKeyFOJNUROFSDPLEH-UHFFFAOYSA-N
XLogP1.10
TPSA111.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.41
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

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2-ethoxy-N-(4-fluorophenyl)pyridine-3-carboxamide
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2-ethoxy-N-[(2-fluorophenyl)methyl]pyridine-3-carboxamide
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2-ethoxy-N'-(3-morpholin-4-ylsulfonylbenzoyl)pyridine-3-carbohydrazide
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2-ethoxy-N-(2-fluorophenyl)pyridine-3-carboxamide
CID 2096181
[2-(Benzylamino)-2-oxoethyl] 2-ethoxypyridine-3-carboxylate
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N-[2-(4-chlorophenyl)ethyl]-2-ethoxypyridine-3-carboxamide
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2-ethoxy-N-(3-phenylsulfanylpropyl)pyridine-3-carboxamide
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2-ethoxy-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide
CID 4794993
2-ethoxy-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 9113215
N-[[4-[(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)methyl]phenyl]methyl]pyridine-3-carboxamide
CID 130431441

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-3-carboxamide?
The IUPAC name of 2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-3-carboxamide (CID 2084510) is 2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-3-carboxamide.
What is the SMILES notation for 2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-3-carboxamide?
The canonical SMILES for 2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-3-carboxamide is CCOc1ncccc1C(=O)NCCc1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of 2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-3-carboxamide?
The InChIKey is FOJNUROFSDPLEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O4S/c1-2-23-16-14(4-3-10-19-16)15(20)18-11-9-12-5-7-13(8-6-12)24(17,21)22/h3-8,10H,2,9,11H2,1H3,(H,18,20)(H2,17,21,22).
What are the key properties of 2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-3-carboxamide?
2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-3-carboxamide has a molecular weight of 349.41 g/mol, XLogP of 1.10, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 2084510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).