1-[[[1-(oxetan-3-yl)azetidin-3-yl]sulfonylamino]methyl]azetidine-3-sulfonamide

C10H20N4O5S2 — CID 155121165

IUPAC1-[[[1-(oxetan-3-yl)azetidin-3-yl]sulfonylamino]methyl]azetidine-3-sulfonamide
SMILESNS(=O)(=O)C1CN(CNS(=O)(=O)C2CN(C3COC3)C2)C1
InChIInChI=1S/C10H20N4O5S2/c11-20(15,16)9-1-13(2-9)7-12-21(17,18)10-3-14(4-10)8-5-19-6-8/h8-10,12H,1-7H2,(H2,11,15,16)
InChIKeyRZHMKSFSDDAODU-UHFFFAOYSA-N
MW340.43 g/mol
LogP-3.08
Rot. Bonds6

About 1-[[[1-(oxetan-3-yl)azetidin-3-yl]sulfonylamino]methyl]azetidine-3-sulfonamide

1-[[[1-(oxetan-3-yl)azetidin-3-yl]sulfonylamino]methyl]azetidine-3-sulfonamide (PubChem CID 155121165) has the molecular formula C10H20N4O5S2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 1-[[[1-(oxetan-3-yl)azetidin-3-yl]sulfonylamino]methyl]azetidine-3-sulfonamide.

Molecular Properties

Compound Name1-[[[1-(oxetan-3-yl)azetidin-3-yl]sulfonylamino]methyl]azetidine-3-sulfonamide
PubChem CID155121165
Molecular FormulaC10H20N4O5S2
Molecular Weight340.43 g/mol
Exact Mass340.09
IUPAC Name1-[[[1-(oxetan-3-yl)azetidin-3-yl]sulfonylamino]methyl]azetidine-3-sulfonamide
SMILESNS(=O)(=O)C1CN(CNS(=O)(=O)C2CN(C3COC3)C2)C1
InChIInChI=1S/C10H20N4O5S2/c11-20(15,16)9-1-13(2-9)7-12-21(17,18)10-3-14(4-10)8-5-19-6-8/h8-10,12H,1-7H2,(H2,11,15,16)
InChIKeyRZHMKSFSDDAODU-UHFFFAOYSA-N
XLogP-3.08
TPSA122.04 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 5-3.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1-[[[1-(oxetan-3-yl)azetidin-3-yl]sulfonylamino]methyl]azetidine-3-sulfonamide?
The IUPAC name of 1-[[[1-(oxetan-3-yl)azetidin-3-yl]sulfonylamino]methyl]azetidine-3-sulfonamide (CID 155121165) is 1-[[[1-(oxetan-3-yl)azetidin-3-yl]sulfonylamino]methyl]azetidine-3-sulfonamide.
What is the SMILES notation for 1-[[[1-(oxetan-3-yl)azetidin-3-yl]sulfonylamino]methyl]azetidine-3-sulfonamide?
The canonical SMILES for 1-[[[1-(oxetan-3-yl)azetidin-3-yl]sulfonylamino]methyl]azetidine-3-sulfonamide is NS(=O)(=O)C1CN(CNS(=O)(=O)C2CN(C3COC3)C2)C1.
What is the InChIKey of 1-[[[1-(oxetan-3-yl)azetidin-3-yl]sulfonylamino]methyl]azetidine-3-sulfonamide?
The InChIKey is RZHMKSFSDDAODU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N4O5S2/c11-20(15,16)9-1-13(2-9)7-12-21(17,18)10-3-14(4-10)8-5-19-6-8/h8-10,12H,1-7H2,(H2,11,15,16).
What are the key properties of 1-[[[1-(oxetan-3-yl)azetidin-3-yl]sulfonylamino]methyl]azetidine-3-sulfonamide?
1-[[[1-(oxetan-3-yl)azetidin-3-yl]sulfonylamino]methyl]azetidine-3-sulfonamide has a molecular weight of 340.43 g/mol, XLogP of -3.08, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[[1-(oxetan-3-yl)azetidin-3-yl]sulfonylamino]methyl]azetidine-3-sulfonamide is sourced from PubChem (CID 155121165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).