3-[(propylsulfamoylamino)methyl]cyclobutan-1-amine

C8H19N3O2S — CID 114812876

IUPAC3-[(propylsulfamoylamino)methyl]cyclobutan-1-amine
SMILESCCCNS(=O)(=O)NCC1CC(N)C1
InChIInChI=1S/C8H19N3O2S/c1-2-3-10-14(12,13)11-6-7-4-8(9)5-7/h7-8,10-11H,2-6,9H2,1H3
InChIKeyGPYQLUIMOVLGRL-UHFFFAOYSA-N
MW221.33 g/mol
LogP-0.44
Rot. Bonds6

About 3-[(propylsulfamoylamino)methyl]cyclobutan-1-amine

3-[(propylsulfamoylamino)methyl]cyclobutan-1-amine (PubChem CID 114812876) has the molecular formula C8H19N3O2S and a molecular weight of 221.33 g/mol. Its IUPAC name is 3-[(propylsulfamoylamino)methyl]cyclobutan-1-amine.

Molecular Properties

Compound Name3-[(propylsulfamoylamino)methyl]cyclobutan-1-amine
PubChem CID114812876
Molecular FormulaC8H19N3O2S
Molecular Weight221.33 g/mol
Exact Mass221.12
IUPAC Name3-[(propylsulfamoylamino)methyl]cyclobutan-1-amine
SMILESCCCNS(=O)(=O)NCC1CC(N)C1
InChIInChI=1S/C8H19N3O2S/c1-2-3-10-14(12,13)11-6-7-4-8(9)5-7/h7-8,10-11H,2-6,9H2,1H3
InChIKeyGPYQLUIMOVLGRL-UHFFFAOYSA-N
XLogP-0.44
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.33
LogP ≤ 5-0.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-bicyclo[1.1.1]pentanylsulfamoyl)bicyclo[1.1.1]pentan-2-amine
CID 134897186
3-methyl-N-(propan-2-ylsulfamoyl)butan-1-amine
CID 22966184
4-methyl-N-(propan-2-ylsulfamoyl)pentan-1-amine
CID 22966185
(2R)-2-(dimethylsulfamoylamino)-4-methylpentane
CID 58923230
N-(2-methylpropylsulfamoyl)cyclohexanamine
CID 84356157
(Sulfamoylamino)methylcyclobutane
CID 112684666
1-Methyl-3-(sulfamoylamino)cyclobutane
CID 115672197
1-Methyl-3-(sulfinatoamino)cyclobutane
CID 130451459
3-Methyl-2-(sulfamoylamino)heptane
CID 154426138
methane;4-methyl-N-(propan-2-ylsulfamoyl)pentan-1-amine
CID 160469218
methane;3-methyl-N-(propan-2-ylsulfamoyl)butan-1-amine
CID 160582271
3-Methylcyclobutane-1,2-diamine;platinum(2+);sulfate;dihydrate
CID 173614032

Frequently Asked Questions

What is the IUPAC name of 3-[(propylsulfamoylamino)methyl]cyclobutan-1-amine?
The IUPAC name of 3-[(propylsulfamoylamino)methyl]cyclobutan-1-amine (CID 114812876) is 3-[(propylsulfamoylamino)methyl]cyclobutan-1-amine.
What is the SMILES notation for 3-[(propylsulfamoylamino)methyl]cyclobutan-1-amine?
The canonical SMILES for 3-[(propylsulfamoylamino)methyl]cyclobutan-1-amine is CCCNS(=O)(=O)NCC1CC(N)C1.
What is the InChIKey of 3-[(propylsulfamoylamino)methyl]cyclobutan-1-amine?
The InChIKey is GPYQLUIMOVLGRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N3O2S/c1-2-3-10-14(12,13)11-6-7-4-8(9)5-7/h7-8,10-11H,2-6,9H2,1H3.
What are the key properties of 3-[(propylsulfamoylamino)methyl]cyclobutan-1-amine?
3-[(propylsulfamoylamino)methyl]cyclobutan-1-amine has a molecular weight of 221.33 g/mol, XLogP of -0.44, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(propylsulfamoylamino)methyl]cyclobutan-1-amine is sourced from PubChem (CID 114812876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).