3-(sulfamoylamino)cyclobutane-1-carboxylic acid

C5H10N2O4S — CID 164651614

IUPAC3-(sulfamoylamino)cyclobutane-1-carboxylic acid
SMILESNS(=O)(=O)NC1CC(C(=O)O)C1
InChIInChI=1S/C5H10N2O4S/c6-12(10,11)7-4-1-3(2-4)5(8)9/h3-4,7H,1-2H2,(H,8,9)(H2,6,10,11)
InChIKeyWULWINBJWDCEIR-UHFFFAOYSA-N
MW194.21 g/mol
LogP-1.36
Rot. Bonds3

About 3-(sulfamoylamino)cyclobutane-1-carboxylic acid

3-(sulfamoylamino)cyclobutane-1-carboxylic acid (PubChem CID 164651614) has the molecular formula C5H10N2O4S and a molecular weight of 194.21 g/mol. Its IUPAC name is 3-(sulfamoylamino)cyclobutane-1-carboxylic acid.

Molecular Properties

Compound Name3-(sulfamoylamino)cyclobutane-1-carboxylic acid
PubChem CID164651614
Molecular FormulaC5H10N2O4S
Molecular Weight194.21 g/mol
Exact Mass194.04
IUPAC Name3-(sulfamoylamino)cyclobutane-1-carboxylic acid
SMILESNS(=O)(=O)NC1CC(C(=O)O)C1
InChIInChI=1S/C5H10N2O4S/c6-12(10,11)7-4-1-3(2-4)5(8)9/h3-4,7H,1-2H2,(H,8,9)(H2,6,10,11)
InChIKeyWULWINBJWDCEIR-UHFFFAOYSA-N
XLogP-1.36
TPSA109.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.21
LogP ≤ 5-1.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(sulfamoylamino)cyclobutane-1-carboxylic acid?
The IUPAC name of 3-(sulfamoylamino)cyclobutane-1-carboxylic acid (CID 164651614) is 3-(sulfamoylamino)cyclobutane-1-carboxylic acid.
What is the SMILES notation for 3-(sulfamoylamino)cyclobutane-1-carboxylic acid?
The canonical SMILES for 3-(sulfamoylamino)cyclobutane-1-carboxylic acid is NS(=O)(=O)NC1CC(C(=O)O)C1.
What is the InChIKey of 3-(sulfamoylamino)cyclobutane-1-carboxylic acid?
The InChIKey is WULWINBJWDCEIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O4S/c6-12(10,11)7-4-1-3(2-4)5(8)9/h3-4,7H,1-2H2,(H,8,9)(H2,6,10,11).
What are the key properties of 3-(sulfamoylamino)cyclobutane-1-carboxylic acid?
3-(sulfamoylamino)cyclobutane-1-carboxylic acid has a molecular weight of 194.21 g/mol, XLogP of -1.36, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(sulfamoylamino)cyclobutane-1-carboxylic acid is sourced from PubChem (CID 164651614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).