N'-(4-ethoxyphenyl)sulfonyl-4-morpholin-4-yl-4-oxobutanehydrazide

C16H23N3O6S — CID 9244445

IUPACN'-(4-ethoxyphenyl)sulfonyl-4-morpholin-4-yl-4-oxobutanehydrazide
SMILESCCOc1ccc(S(=O)(=O)NNC(=O)CCC(=O)N2CCOCC2)cc1
InChIInChI=1S/C16H23N3O6S/c1-2-25-13-3-5-14(6-4-13)26(22,23)18-17-15(20)7-8-16(21)19-9-11-24-12-10-19/h3-6,18H,2,7-12H2,1H3,(H,17,20)
InChIKeyOEYQIUHXYLLPDY-UHFFFAOYSA-N
MW385.44 g/mol
LogP0.03
Rot. Bonds8

About N'-(4-ethoxyphenyl)sulfonyl-4-morpholin-4-yl-4-oxobutanehydrazide

N'-(4-ethoxyphenyl)sulfonyl-4-morpholin-4-yl-4-oxobutanehydrazide (PubChem CID 9244445) has the molecular formula C16H23N3O6S and a molecular weight of 385.44 g/mol. Its IUPAC name is N'-(4-ethoxyphenyl)sulfonyl-4-morpholin-4-yl-4-oxobutanehydrazide.

Molecular Properties

Compound NameN'-(4-ethoxyphenyl)sulfonyl-4-morpholin-4-yl-4-oxobutanehydrazide
PubChem CID9244445
Molecular FormulaC16H23N3O6S
Molecular Weight385.44 g/mol
Exact Mass385.13
IUPAC NameN'-(4-ethoxyphenyl)sulfonyl-4-morpholin-4-yl-4-oxobutanehydrazide
SMILESCCOc1ccc(S(=O)(=O)NNC(=O)CCC(=O)N2CCOCC2)cc1
InChIInChI=1S/C16H23N3O6S/c1-2-25-13-3-5-14(6-4-13)26(22,23)18-17-15(20)7-8-16(21)19-9-11-24-12-10-19/h3-6,18H,2,7-12H2,1H3,(H,17,20)
InChIKeyOEYQIUHXYLLPDY-UHFFFAOYSA-N
XLogP0.03
TPSA114.04 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.44
LogP ≤ 50.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

1-N',6-N'-bis[(4-ethoxyphenyl)sulfonyl]hexanedihydrazide
CID 3116496
(2-morpholin-4-yl-2-oxoethyl) 3-[(4-ethoxyphenyl)sulfonylamino]propanoate
CID 4043815
4-ethoxy-N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]benzenesulfonamide
CID 110347837
N'-(4-ethoxyphenyl)sulfonyl-2-phenylacetohydrazide
CID 7974595
1-[4-[2-(4-ethoxyphenyl)acetyl]piperazin-1-yl]-2-morpholin-4-ylethane-1,2-dione
CID 55471046
N'-(4-ethoxyphenyl)sulfonyl-2-phenylsulfanylacetohydrazide
CID 7478638
2-(4-bromophenyl)-N'-(4-ethoxyphenyl)sulfonylacetohydrazide
CID 7478651
4-ethoxy-N-(2-morpholin-4-yl-2-oxoethyl)benzamide
CID 27258304
4-ethoxy-N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxopropyl]benzenesulfonamide
CID 3331081
2-(1,3-dioxoisoindol-2-yl)-N'-(4-ethoxyphenyl)sulfonylacetohydrazide
CID 9244319
3-(3,4-dimethoxyphenyl)-N'-(4-ethoxyphenyl)sulfonylpropanehydrazide
CID 9243942
3-(1,3-benzoxazol-2-yl)-N'-(4-ethoxyphenyl)sulfonylpropanehydrazide
CID 9427644

Frequently Asked Questions

What is the IUPAC name of N'-(4-ethoxyphenyl)sulfonyl-4-morpholin-4-yl-4-oxobutanehydrazide?
The IUPAC name of N'-(4-ethoxyphenyl)sulfonyl-4-morpholin-4-yl-4-oxobutanehydrazide (CID 9244445) is N'-(4-ethoxyphenyl)sulfonyl-4-morpholin-4-yl-4-oxobutanehydrazide.
What is the SMILES notation for N'-(4-ethoxyphenyl)sulfonyl-4-morpholin-4-yl-4-oxobutanehydrazide?
The canonical SMILES for N'-(4-ethoxyphenyl)sulfonyl-4-morpholin-4-yl-4-oxobutanehydrazide is CCOc1ccc(S(=O)(=O)NNC(=O)CCC(=O)N2CCOCC2)cc1.
What is the InChIKey of N'-(4-ethoxyphenyl)sulfonyl-4-morpholin-4-yl-4-oxobutanehydrazide?
The InChIKey is OEYQIUHXYLLPDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O6S/c1-2-25-13-3-5-14(6-4-13)26(22,23)18-17-15(20)7-8-16(21)19-9-11-24-12-10-19/h3-6,18H,2,7-12H2,1H3,(H,17,20).
What are the key properties of N'-(4-ethoxyphenyl)sulfonyl-4-morpholin-4-yl-4-oxobutanehydrazide?
N'-(4-ethoxyphenyl)sulfonyl-4-morpholin-4-yl-4-oxobutanehydrazide has a molecular weight of 385.44 g/mol, XLogP of 0.03, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-ethoxyphenyl)sulfonyl-4-morpholin-4-yl-4-oxobutanehydrazide is sourced from PubChem (CID 9244445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).