4-morpholin-4-ylsulfonylbenzohydrazide

C11H15N3O4S — CID 864339

IUPAC4-morpholin-4-ylsulfonylbenzohydrazide
SMILESNNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1
InChIInChI=1S/C11H15N3O4S/c12-13-11(15)9-1-3-10(4-2-9)19(16,17)14-5-7-18-8-6-14/h1-4H,5-8,12H2,(H,13,15)
InChIKeyKFEAEBVYSWALAN-UHFFFAOYSA-N
MW285.32 g/mol
LogP-0.69
Rot. Bonds3

About 4-morpholin-4-ylsulfonylbenzohydrazide

4-morpholin-4-ylsulfonylbenzohydrazide (PubChem CID 864339) has the molecular formula C11H15N3O4S and a molecular weight of 285.32 g/mol. Its IUPAC name is 4-morpholin-4-ylsulfonylbenzohydrazide.

Molecular Properties

Compound Name4-morpholin-4-ylsulfonylbenzohydrazide
PubChem CID864339
Molecular FormulaC11H15N3O4S
Molecular Weight285.32 g/mol
Exact Mass285.08
IUPAC Name4-morpholin-4-ylsulfonylbenzohydrazide
SMILESNNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1
InChIInChI=1S/C11H15N3O4S/c12-13-11(15)9-1-3-10(4-2-9)19(16,17)14-5-7-18-8-6-14/h1-4H,5-8,12H2,(H,13,15)
InChIKeyKFEAEBVYSWALAN-UHFFFAOYSA-N
XLogP-0.69
TPSA101.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.32
LogP ≤ 5-0.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4-(Hydrazinecarbonyl)benzenesulfonamide
CID 318174
N-(morpholin-4-yl)benzamide
CID 229509
4-Sulfamoyl-N-(3-morpholinopropyl)benzamide (I-1)
CID 25060316
N'-(4-methylbenzoyl)-3-morpholin-4-ylsulfonylbenzohydrazide
CID 2358276
4-methyl-N'-(4-piperidin-1-ylsulfonylbenzoyl)benzohydrazide
CID 2439280
N'-benzoyl-3-piperidin-1-ylsulfonylbenzohydrazide
CID 2445760
N-[2-(diethylamino)ethyl]-4-(hydrazinecarbonyl)benzene-1-sulfonamide
CID 2446584
N'-[4-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoyl]-2-fluorobenzohydrazide
CID 4877378
4-(Morpholine-4-carbonyl)-N,N-dipropyl-benzenesulfonamide
CID 1070318
3-(4-(Morpholine-4-sulfonyl)phenyl)propanehydrazide
CID 2380270
3-(Morpholine-4-sulfonyl)benzohydrazide
CID 877246
3-(Hydrazinecarbonyl)-N,N-dimethylbenzene-1-sulfonamide
CID 3848951

Frequently Asked Questions

What is the IUPAC name of 4-morpholin-4-ylsulfonylbenzohydrazide?
The IUPAC name of 4-morpholin-4-ylsulfonylbenzohydrazide (CID 864339) is 4-morpholin-4-ylsulfonylbenzohydrazide.
What is the SMILES notation for 4-morpholin-4-ylsulfonylbenzohydrazide?
The canonical SMILES for 4-morpholin-4-ylsulfonylbenzohydrazide is NNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1.
What is the InChIKey of 4-morpholin-4-ylsulfonylbenzohydrazide?
The InChIKey is KFEAEBVYSWALAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O4S/c12-13-11(15)9-1-3-10(4-2-9)19(16,17)14-5-7-18-8-6-14/h1-4H,5-8,12H2,(H,13,15).
What are the key properties of 4-morpholin-4-ylsulfonylbenzohydrazide?
4-morpholin-4-ylsulfonylbenzohydrazide has a molecular weight of 285.32 g/mol, XLogP of -0.69, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-4-ylsulfonylbenzohydrazide is sourced from PubChem (CID 864339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).