1-propan-2-yl-3-(sulfamoylamino)cyclobutane

C7H16N2O2S — CID 131201532

IUPAC1-propan-2-yl-3-(sulfamoylamino)cyclobutane
SMILESCC(C)C1CC(NS(N)(=O)=O)C1
InChIInChI=1S/C7H16N2O2S/c1-5(2)6-3-7(4-6)9-12(8,10)11/h5-7,9H,3-4H2,1-2H3,(H2,8,10,11)
InChIKeyPGJGJOUJPWTYAX-UHFFFAOYSA-N
MW192.28 g/mol
LogP0.21
Rot. Bonds3

About 1-propan-2-yl-3-(sulfamoylamino)cyclobutane

1-propan-2-yl-3-(sulfamoylamino)cyclobutane (PubChem CID 131201532) has the molecular formula C7H16N2O2S and a molecular weight of 192.28 g/mol. Its IUPAC name is 1-propan-2-yl-3-(sulfamoylamino)cyclobutane.

Molecular Properties

Compound Name1-propan-2-yl-3-(sulfamoylamino)cyclobutane
PubChem CID131201532
Molecular FormulaC7H16N2O2S
Molecular Weight192.28 g/mol
Exact Mass192.09
IUPAC Name1-propan-2-yl-3-(sulfamoylamino)cyclobutane
SMILESCC(C)C1CC(NS(N)(=O)=O)C1
InChIInChI=1S/C7H16N2O2S/c1-5(2)6-3-7(4-6)9-12(8,10)11/h5-7,9H,3-4H2,1-2H3,(H2,8,10,11)
InChIKeyPGJGJOUJPWTYAX-UHFFFAOYSA-N
XLogP0.21
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.28
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-methyl-N-(propan-2-ylsulfamoyl)pentan-1-amine
CID 22966185
N-(3-propan-2-ylcyclobutyl)methanesulfonamide
CID 58254203
1-Propan-2-yl-3-(sulfinoamino)cyclobutane
CID 68060930
5-Methyl-1-(sulfamoylamino)hexane
CID 112692643
1-Methyl-3-(sulfamoylamino)cyclobutane
CID 115672197
1-Ethyl-3-(sulfinatoamino)cyclobutane
CID 130451284
2-Methyl-5-(sulfinatoamino)hexane
CID 151820645
3-Methyl-2-(sulfamoylamino)heptane
CID 154426138
2-Methyl-3-[(sulfamoylamino)methyl]pentane
CID 155138019
methane;4-methyl-N-(propan-2-ylsulfamoyl)pentan-1-amine
CID 160469218
sodium N-(5-methylhexan-2-yl)sulfamate
CID 174221612
4-Methylhexan-2-amine sulfate
CID 5745072

Frequently Asked Questions

What is the IUPAC name of 1-propan-2-yl-3-(sulfamoylamino)cyclobutane?
The IUPAC name of 1-propan-2-yl-3-(sulfamoylamino)cyclobutane (CID 131201532) is 1-propan-2-yl-3-(sulfamoylamino)cyclobutane.
What is the SMILES notation for 1-propan-2-yl-3-(sulfamoylamino)cyclobutane?
The canonical SMILES for 1-propan-2-yl-3-(sulfamoylamino)cyclobutane is CC(C)C1CC(NS(N)(=O)=O)C1.
What is the InChIKey of 1-propan-2-yl-3-(sulfamoylamino)cyclobutane?
The InChIKey is PGJGJOUJPWTYAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O2S/c1-5(2)6-3-7(4-6)9-12(8,10)11/h5-7,9H,3-4H2,1-2H3,(H2,8,10,11).
What are the key properties of 1-propan-2-yl-3-(sulfamoylamino)cyclobutane?
1-propan-2-yl-3-(sulfamoylamino)cyclobutane has a molecular weight of 192.28 g/mol, XLogP of 0.21, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-yl-3-(sulfamoylamino)cyclobutane is sourced from PubChem (CID 131201532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).