[3-(1,1-dioxothiazinan-2-yl)phenyl]hydrazine

C10H15N3O2S — CID 82084710

IUPAC[3-(1,1-dioxothiazinan-2-yl)phenyl]hydrazine
SMILESNNc1cccc(N2CCCCS2(=O)=O)c1
InChIInChI=1S/C10H15N3O2S/c11-12-9-4-3-5-10(8-9)13-6-1-2-7-16(13,14)15/h3-5,8,12H,1-2,6-7,11H2
InChIKeyLWQSDLVEOBDDLS-UHFFFAOYSA-N
MW241.32 g/mol
LogP0.90
Rot. Bonds2

About [3-(1,1-dioxothiazinan-2-yl)phenyl]hydrazine

[3-(1,1-dioxothiazinan-2-yl)phenyl]hydrazine (PubChem CID 82084710) has the molecular formula C10H15N3O2S and a molecular weight of 241.32 g/mol. Its IUPAC name is [3-(1,1-dioxothiazinan-2-yl)phenyl]hydrazine.

Molecular Properties

Compound Name[3-(1,1-dioxothiazinan-2-yl)phenyl]hydrazine
PubChem CID82084710
Molecular FormulaC10H15N3O2S
Molecular Weight241.32 g/mol
Exact Mass241.09
IUPAC Name[3-(1,1-dioxothiazinan-2-yl)phenyl]hydrazine
SMILESNNc1cccc(N2CCCCS2(=O)=O)c1
InChIInChI=1S/C10H15N3O2S/c11-12-9-4-3-5-10(8-9)13-6-1-2-7-16(13,14)15/h3-5,8,12H,1-2,6-7,11H2
InChIKeyLWQSDLVEOBDDLS-UHFFFAOYSA-N
XLogP0.90
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.32
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(1,1-dioxothiazinan-2-yl)phenyl]prop-2-enamide
CID 166415169
2-(3-fluorophenyl)thiazinane 1,1-dioxide
CID 82081520
N-[3-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]propane-2-sulfonamide
CID 7635594
N-[3-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]cyclopentanesulfonamide
CID 110302255
3-(1,1-dioxothiazinan-2-yl)-N-phenylbenzamide
CID 7686078
N-[3-(1,1-dioxothiazinan-2-yl)phenyl]thiophene-2-sulfonamide
CID 112505540
4-tert-butyl-N-[3-(1,1-dioxothiazinan-2-yl)phenyl]benzamide
CID 112505496
3-chloro-N-[3-(1,1-dioxothiazinan-2-yl)phenyl]benzamide
CID 112505513
N-[3-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-2-oxo-2-piperidin-1-ylacetamide
CID 45493330
(2R)-2-amino-N-[3-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]propanamide
CID 119289907
3-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-(ethylsulfamoyl)aniline
CID 110621354
4-amino-N-[3-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]butanamide
CID 22690097

Frequently Asked Questions

What is the IUPAC name of [3-(1,1-dioxothiazinan-2-yl)phenyl]hydrazine?
The IUPAC name of [3-(1,1-dioxothiazinan-2-yl)phenyl]hydrazine (CID 82084710) is [3-(1,1-dioxothiazinan-2-yl)phenyl]hydrazine.
What is the SMILES notation for [3-(1,1-dioxothiazinan-2-yl)phenyl]hydrazine?
The canonical SMILES for [3-(1,1-dioxothiazinan-2-yl)phenyl]hydrazine is NNc1cccc(N2CCCCS2(=O)=O)c1.
What is the InChIKey of [3-(1,1-dioxothiazinan-2-yl)phenyl]hydrazine?
The InChIKey is LWQSDLVEOBDDLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2S/c11-12-9-4-3-5-10(8-9)13-6-1-2-7-16(13,14)15/h3-5,8,12H,1-2,6-7,11H2.
What are the key properties of [3-(1,1-dioxothiazinan-2-yl)phenyl]hydrazine?
[3-(1,1-dioxothiazinan-2-yl)phenyl]hydrazine has a molecular weight of 241.32 g/mol, XLogP of 0.90, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(1,1-dioxothiazinan-2-yl)phenyl]hydrazine is sourced from PubChem (CID 82084710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).