1-methyl-1-[(sulfamoylamino)methyl]cyclobutane

C6H14N2O2S — CID 103736200

IUPAC1-methyl-1-[(sulfamoylamino)methyl]cyclobutane
SMILESCC1(CNS(N)(=O)=O)CCC1
InChIInChI=1S/C6H14N2O2S/c1-6(3-2-4-6)5-8-11(7,9)10/h8H,2-5H2,1H3,(H2,7,9,10)
InChIKeyUYRQIYKWEZUEJO-UHFFFAOYSA-N
MW178.26 g/mol
LogP-0.03
Rot. Bonds3

About 1-methyl-1-[(sulfamoylamino)methyl]cyclobutane

1-methyl-1-[(sulfamoylamino)methyl]cyclobutane (PubChem CID 103736200) has the molecular formula C6H14N2O2S and a molecular weight of 178.26 g/mol. Its IUPAC name is 1-methyl-1-[(sulfamoylamino)methyl]cyclobutane.

Molecular Properties

Compound Name1-methyl-1-[(sulfamoylamino)methyl]cyclobutane
PubChem CID103736200
Molecular FormulaC6H14N2O2S
Molecular Weight178.26 g/mol
Exact Mass178.08
IUPAC Name1-methyl-1-[(sulfamoylamino)methyl]cyclobutane
SMILESCC1(CNS(N)(=O)=O)CCC1
InChIInChI=1S/C6H14N2O2S/c1-6(3-2-4-6)5-8-11(7,9)10/h8H,2-5H2,1H3,(H2,7,9,10)
InChIKeyUYRQIYKWEZUEJO-UHFFFAOYSA-N
XLogP-0.03
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.26
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-1-[(sulfamoylamino)methyl]cyclobutane?
The IUPAC name of 1-methyl-1-[(sulfamoylamino)methyl]cyclobutane (CID 103736200) is 1-methyl-1-[(sulfamoylamino)methyl]cyclobutane.
What is the SMILES notation for 1-methyl-1-[(sulfamoylamino)methyl]cyclobutane?
The canonical SMILES for 1-methyl-1-[(sulfamoylamino)methyl]cyclobutane is CC1(CNS(N)(=O)=O)CCC1.
What is the InChIKey of 1-methyl-1-[(sulfamoylamino)methyl]cyclobutane?
The InChIKey is UYRQIYKWEZUEJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O2S/c1-6(3-2-4-6)5-8-11(7,9)10/h8H,2-5H2,1H3,(H2,7,9,10).
What are the key properties of 1-methyl-1-[(sulfamoylamino)methyl]cyclobutane?
1-methyl-1-[(sulfamoylamino)methyl]cyclobutane has a molecular weight of 178.26 g/mol, XLogP of -0.03, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-1-[(sulfamoylamino)methyl]cyclobutane is sourced from PubChem (CID 103736200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).