2-ethoxy-N'-(3-morpholin-4-ylsulfonylbenzoyl)pyridine-3-carbohydrazide

C19H22N4O6S — CID 2089686

IUPAC2-ethoxy-N'-(3-morpholin-4-ylsulfonylbenzoyl)pyridine-3-carbohydrazide
SMILESCCOc1ncccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1
InChIInChI=1S/C19H22N4O6S/c1-2-29-19-16(7-4-8-20-19)18(25)22-21-17(24)14-5-3-6-15(13-14)30(26,27)23-9-11-28-12-10-23/h3-8,13H,2,9-12H2,1H3,(H,21,24)(H,22,25)
InChIKeyXQIDTGCABPIZPJ-UHFFFAOYSA-N
MW434.47 g/mol
LogP0.58
Rot. Bonds6

About 2-ethoxy-N'-(3-morpholin-4-ylsulfonylbenzoyl)pyridine-3-carbohydrazide

2-ethoxy-N'-(3-morpholin-4-ylsulfonylbenzoyl)pyridine-3-carbohydrazide (PubChem CID 2089686) has the molecular formula C19H22N4O6S and a molecular weight of 434.47 g/mol. Its IUPAC name is 2-ethoxy-N'-(3-morpholin-4-ylsulfonylbenzoyl)pyridine-3-carbohydrazide.

Molecular Properties

Compound Name2-ethoxy-N'-(3-morpholin-4-ylsulfonylbenzoyl)pyridine-3-carbohydrazide
PubChem CID2089686
Molecular FormulaC19H22N4O6S
Molecular Weight434.47 g/mol
Exact Mass434.13
IUPAC Name2-ethoxy-N'-(3-morpholin-4-ylsulfonylbenzoyl)pyridine-3-carbohydrazide
SMILESCCOc1ncccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1
InChIInChI=1S/C19H22N4O6S/c1-2-29-19-16(7-4-8-20-19)18(25)22-21-17(24)14-5-3-6-15(13-14)30(26,27)23-9-11-28-12-10-23/h3-8,13H,2,9-12H2,1H3,(H,21,24)(H,22,25)
InChIKeyXQIDTGCABPIZPJ-UHFFFAOYSA-N
XLogP0.58
TPSA126.93 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.47
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-ethoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-3-carboxamide
CID 2084510
2-ethoxy-N-(4-pyrrolidin-1-ylsulfonylphenyl)pyridine-3-carboxamide
CID 3981165
2-ethoxy-N-(2-methyl-5-piperidin-1-ylsulfonylphenyl)pyridine-3-carboxamide
CID 7951679
3-[[(2-ethoxypyridine-3-carbonyl)amino]carbamoyl]-N-(2-methoxyphenyl)benzenesulfonamide
CID 24540494
N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-2-ethoxypyridine-3-carboxamide
CID 3691621
2-ethoxy-N-(2-ethoxy-5-piperidin-1-ylsulfonylphenyl)pyridine-3-carboxamide
CID 4963791
2-ethoxy-N-(3-morpholin-4-ylsulfonylphenyl)pyridine-3-carboxamide
CID 5012564
[2-(4-Morpholin-4-ylsulfonylanilino)-2-oxoethyl] 2-ethoxypyridine-3-carboxylate
CID 2497126
2-ethoxy-N-(3-piperidin-1-ylsulfonylphenyl)pyridine-3-carboxamide
CID 4827305
2-ethoxy-N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)pyridine-3-carboxamide
CID 8014521
3-[[(2-ethoxypyridine-3-carbonyl)amino]carbamoyl]-N-(4-methoxyphenyl)benzenesulfonamide
CID 24818159
N-[4-[[(2-ethoxypyridine-3-carbonyl)amino]carbamoyl]phenyl]thiophene-2-sulfonamide
CID 24979560

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N'-(3-morpholin-4-ylsulfonylbenzoyl)pyridine-3-carbohydrazide?
The IUPAC name of 2-ethoxy-N'-(3-morpholin-4-ylsulfonylbenzoyl)pyridine-3-carbohydrazide (CID 2089686) is 2-ethoxy-N'-(3-morpholin-4-ylsulfonylbenzoyl)pyridine-3-carbohydrazide.
What is the SMILES notation for 2-ethoxy-N'-(3-morpholin-4-ylsulfonylbenzoyl)pyridine-3-carbohydrazide?
The canonical SMILES for 2-ethoxy-N'-(3-morpholin-4-ylsulfonylbenzoyl)pyridine-3-carbohydrazide is CCOc1ncccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1.
What is the InChIKey of 2-ethoxy-N'-(3-morpholin-4-ylsulfonylbenzoyl)pyridine-3-carbohydrazide?
The InChIKey is XQIDTGCABPIZPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O6S/c1-2-29-19-16(7-4-8-20-19)18(25)22-21-17(24)14-5-3-6-15(13-14)30(26,27)23-9-11-28-12-10-23/h3-8,13H,2,9-12H2,1H3,(H,21,24)(H,22,25).
What are the key properties of 2-ethoxy-N'-(3-morpholin-4-ylsulfonylbenzoyl)pyridine-3-carbohydrazide?
2-ethoxy-N'-(3-morpholin-4-ylsulfonylbenzoyl)pyridine-3-carbohydrazide has a molecular weight of 434.47 g/mol, XLogP of 0.58, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N'-(3-morpholin-4-ylsulfonylbenzoyl)pyridine-3-carbohydrazide is sourced from PubChem (CID 2089686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).