(sulfamoylamino)methylcyclobutane

C5H12N2O2S — CID 112684666

IUPAC(sulfamoylamino)methylcyclobutane
SMILESNS(=O)(=O)NCC1CCC1
InChIInChI=1S/C5H12N2O2S/c6-10(8,9)7-4-5-2-1-3-5/h5,7H,1-4H2,(H2,6,8,9)
InChIKeyQAKVCNUITASCBN-UHFFFAOYSA-N
MW164.23 g/mol
LogP-0.42
Rot. Bonds3

About (sulfamoylamino)methylcyclobutane

(sulfamoylamino)methylcyclobutane (PubChem CID 112684666) has the molecular formula C5H12N2O2S and a molecular weight of 164.23 g/mol. Its IUPAC name is (sulfamoylamino)methylcyclobutane.

Molecular Properties

Compound Name(sulfamoylamino)methylcyclobutane
PubChem CID112684666
Molecular FormulaC5H12N2O2S
Molecular Weight164.23 g/mol
Exact Mass164.06
IUPAC Name(sulfamoylamino)methylcyclobutane
SMILESNS(=O)(=O)NCC1CCC1
InChIInChI=1S/C5H12N2O2S/c6-10(8,9)7-4-5-2-1-3-5/h5,7H,1-4H2,(H2,6,8,9)
InChIKeyQAKVCNUITASCBN-UHFFFAOYSA-N
XLogP-0.42
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.23
LogP ≤ 5-0.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (sulfamoylamino)methylcyclobutane?
The IUPAC name of (sulfamoylamino)methylcyclobutane (CID 112684666) is (sulfamoylamino)methylcyclobutane.
What is the SMILES notation for (sulfamoylamino)methylcyclobutane?
The canonical SMILES for (sulfamoylamino)methylcyclobutane is NS(=O)(=O)NCC1CCC1.
What is the InChIKey of (sulfamoylamino)methylcyclobutane?
The InChIKey is QAKVCNUITASCBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O2S/c6-10(8,9)7-4-5-2-1-3-5/h5,7H,1-4H2,(H2,6,8,9).
What are the key properties of (sulfamoylamino)methylcyclobutane?
(sulfamoylamino)methylcyclobutane has a molecular weight of 164.23 g/mol, XLogP of -0.42, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (sulfamoylamino)methylcyclobutane is sourced from PubChem (CID 112684666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).