N-(4-hydrazinyloxan-3-yl)-N-methylmethanesulfonamide

C7H17N3O3S — CID 154472091

IUPACN-(4-hydrazinyloxan-3-yl)-N-methylmethanesulfonamide
SMILESCN(C1COCCC1NN)S(C)(=O)=O
InChIInChI=1S/C7H17N3O3S/c1-10(14(2,11)12)7-5-13-4-3-6(7)9-8/h6-7,9H,3-5,8H2,1-2H3
InChIKeyJAJDOMSOIQIOOK-UHFFFAOYSA-N
MW223.30 g/mol
LogP-1.50
Rot. Bonds3

About N-(4-hydrazinyloxan-3-yl)-N-methylmethanesulfonamide

N-(4-hydrazinyloxan-3-yl)-N-methylmethanesulfonamide (PubChem CID 154472091) has the molecular formula C7H17N3O3S and a molecular weight of 223.30 g/mol. Its IUPAC name is N-(4-hydrazinyloxan-3-yl)-N-methylmethanesulfonamide.

Molecular Properties

Compound NameN-(4-hydrazinyloxan-3-yl)-N-methylmethanesulfonamide
PubChem CID154472091
Molecular FormulaC7H17N3O3S
Molecular Weight223.30 g/mol
Exact Mass223.10
IUPAC NameN-(4-hydrazinyloxan-3-yl)-N-methylmethanesulfonamide
SMILESCN(C1COCCC1NN)S(C)(=O)=O
InChIInChI=1S/C7H17N3O3S/c1-10(14(2,11)12)7-5-13-4-3-6(7)9-8/h6-7,9H,3-5,8H2,1-2H3
InChIKeyJAJDOMSOIQIOOK-UHFFFAOYSA-N
XLogP-1.50
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.30
LogP ≤ 5-1.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(4-hydrazinyloxan-3-yl)-N-methylmethanesulfonamide?
The IUPAC name of N-(4-hydrazinyloxan-3-yl)-N-methylmethanesulfonamide (CID 154472091) is N-(4-hydrazinyloxan-3-yl)-N-methylmethanesulfonamide.
What is the SMILES notation for N-(4-hydrazinyloxan-3-yl)-N-methylmethanesulfonamide?
The canonical SMILES for N-(4-hydrazinyloxan-3-yl)-N-methylmethanesulfonamide is CN(C1COCCC1NN)S(C)(=O)=O.
What is the InChIKey of N-(4-hydrazinyloxan-3-yl)-N-methylmethanesulfonamide?
The InChIKey is JAJDOMSOIQIOOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N3O3S/c1-10(14(2,11)12)7-5-13-4-3-6(7)9-8/h6-7,9H,3-5,8H2,1-2H3.
What are the key properties of N-(4-hydrazinyloxan-3-yl)-N-methylmethanesulfonamide?
N-(4-hydrazinyloxan-3-yl)-N-methylmethanesulfonamide has a molecular weight of 223.30 g/mol, XLogP of -1.50, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydrazinyloxan-3-yl)-N-methylmethanesulfonamide is sourced from PubChem (CID 154472091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).