[propan-2-yl(sulfamoyl)amino]methylcyclobutane

C8H18N2O2S — CID 167048992

IUPAC[propan-2-yl(sulfamoyl)amino]methylcyclobutane
SMILESCC(C)N(CC1CCC1)S(N)(=O)=O
InChIInChI=1S/C8H18N2O2S/c1-7(2)10(13(9,11)12)6-8-4-3-5-8/h7-8H,3-6H2,1-2H3,(H2,9,11,12)
InChIKeyZWLCRZOVLKDJCU-UHFFFAOYSA-N
MW206.31 g/mol
LogP0.70
Rot. Bonds4

About [propan-2-yl(sulfamoyl)amino]methylcyclobutane

[propan-2-yl(sulfamoyl)amino]methylcyclobutane (PubChem CID 167048992) has the molecular formula C8H18N2O2S and a molecular weight of 206.31 g/mol. Its IUPAC name is [propan-2-yl(sulfamoyl)amino]methylcyclobutane.

Molecular Properties

Compound Name[propan-2-yl(sulfamoyl)amino]methylcyclobutane
PubChem CID167048992
Molecular FormulaC8H18N2O2S
Molecular Weight206.31 g/mol
Exact Mass206.11
IUPAC Name[propan-2-yl(sulfamoyl)amino]methylcyclobutane
SMILESCC(C)N(CC1CCC1)S(N)(=O)=O
InChIInChI=1S/C8H18N2O2S/c1-7(2)10(13(9,11)12)6-8-4-3-5-8/h7-8H,3-6H2,1-2H3,(H2,9,11,12)
InChIKeyZWLCRZOVLKDJCU-UHFFFAOYSA-N
XLogP0.70
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.31
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [propan-2-yl(sulfamoyl)amino]methylcyclobutane?
The IUPAC name of [propan-2-yl(sulfamoyl)amino]methylcyclobutane (CID 167048992) is [propan-2-yl(sulfamoyl)amino]methylcyclobutane.
What is the SMILES notation for [propan-2-yl(sulfamoyl)amino]methylcyclobutane?
The canonical SMILES for [propan-2-yl(sulfamoyl)amino]methylcyclobutane is CC(C)N(CC1CCC1)S(N)(=O)=O.
What is the InChIKey of [propan-2-yl(sulfamoyl)amino]methylcyclobutane?
The InChIKey is ZWLCRZOVLKDJCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O2S/c1-7(2)10(13(9,11)12)6-8-4-3-5-8/h7-8H,3-6H2,1-2H3,(H2,9,11,12).
What are the key properties of [propan-2-yl(sulfamoyl)amino]methylcyclobutane?
[propan-2-yl(sulfamoyl)amino]methylcyclobutane has a molecular weight of 206.31 g/mol, XLogP of 0.70, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [propan-2-yl(sulfamoyl)amino]methylcyclobutane is sourced from PubChem (CID 167048992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).