1-hydroxy-3-[(sulfamoylamino)methyl]cyclobutane

C5H12N2O3S — CID 112573825

IUPAC1-hydroxy-3-[(sulfamoylamino)methyl]cyclobutane
SMILESNS(=O)(=O)NCC1CC(O)C1
InChIInChI=1S/C5H12N2O3S/c6-11(9,10)7-3-4-1-5(8)2-4/h4-5,7-8H,1-3H2,(H2,6,9,10)
InChIKeyLQCNHBOCMDYPRF-UHFFFAOYSA-N
MW180.23 g/mol
LogP-1.45
Rot. Bonds3

About 1-hydroxy-3-[(sulfamoylamino)methyl]cyclobutane

1-hydroxy-3-[(sulfamoylamino)methyl]cyclobutane (PubChem CID 112573825) has the molecular formula C5H12N2O3S and a molecular weight of 180.23 g/mol. Its IUPAC name is 1-hydroxy-3-[(sulfamoylamino)methyl]cyclobutane.

Molecular Properties

Compound Name1-hydroxy-3-[(sulfamoylamino)methyl]cyclobutane
PubChem CID112573825
Molecular FormulaC5H12N2O3S
Molecular Weight180.23 g/mol
Exact Mass180.06
IUPAC Name1-hydroxy-3-[(sulfamoylamino)methyl]cyclobutane
SMILESNS(=O)(=O)NCC1CC(O)C1
InChIInChI=1S/C5H12N2O3S/c6-11(9,10)7-3-4-1-5(8)2-4/h4-5,7-8H,1-3H2,(H2,6,9,10)
InChIKeyLQCNHBOCMDYPRF-UHFFFAOYSA-N
XLogP-1.45
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.23
LogP ≤ 5-1.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-(Aminomethyl)cyclobutan-1-ol
CID 22408680
3-[(2,2,2-Trifluoroethylsulfamoylamino)methyl]cyclobutan-1-ol
CID 114809650
3-[[[3-Aminopropyl(methyl)sulfamoyl]-methylamino]methyl]cyclobutan-1-ol
CID 65982934
1-[[[Butyl(methyl)sulfamoyl]amino]methyl]-3-hydroxycyclobutane
CID 66004612
1-Hydroxy-3-[[[methyl(propan-2-yl)sulfamoyl]amino]methyl]cyclobutane
CID 66005456
N-[(3-hydroxycyclobutyl)methyl]methanesulfonamide
CID 66006111
1-[(Dipropylsulfamoylamino)methyl]-3-hydroxycyclobutane
CID 66006529
1-[(Diethylsulfamoylamino)methyl]-3-hydroxycyclobutane
CID 66006532
1-[(Dimethylsulfamoylamino)methyl]-3-hydroxycyclobutane
CID 66007399
3-Ethyl-2-hydroxy-1-(sulfamoylamino)pentane
CID 103657859
5-(2-Methylpropylsulfamoylamino)pentan-2-ol
CID 106125878
4-Methyl-1-(methylsulfamoylamino)pentan-2-ol
CID 107155389

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-3-[(sulfamoylamino)methyl]cyclobutane?
The IUPAC name of 1-hydroxy-3-[(sulfamoylamino)methyl]cyclobutane (CID 112573825) is 1-hydroxy-3-[(sulfamoylamino)methyl]cyclobutane.
What is the SMILES notation for 1-hydroxy-3-[(sulfamoylamino)methyl]cyclobutane?
The canonical SMILES for 1-hydroxy-3-[(sulfamoylamino)methyl]cyclobutane is NS(=O)(=O)NCC1CC(O)C1.
What is the InChIKey of 1-hydroxy-3-[(sulfamoylamino)methyl]cyclobutane?
The InChIKey is LQCNHBOCMDYPRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O3S/c6-11(9,10)7-3-4-1-5(8)2-4/h4-5,7-8H,1-3H2,(H2,6,9,10).
What are the key properties of 1-hydroxy-3-[(sulfamoylamino)methyl]cyclobutane?
1-hydroxy-3-[(sulfamoylamino)methyl]cyclobutane has a molecular weight of 180.23 g/mol, XLogP of -1.45, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-3-[(sulfamoylamino)methyl]cyclobutane is sourced from PubChem (CID 112573825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).