3-[[3-aminopropyl(methyl)sulfamoyl]amino]-2-methyloxolane

C9H21N3O3S — CID 82726272

IUPAC3-[[3-aminopropyl(methyl)sulfamoyl]amino]-2-methyloxolane
SMILESCC1OCCC1NS(=O)(=O)N(C)CCCN
InChIInChI=1S/C9H21N3O3S/c1-8-9(4-7-15-8)11-16(13,14)12(2)6-3-5-10/h8-9,11H,3-7,10H2,1-2H3
InChIKeyFPYATPWSRUDSJO-UHFFFAOYSA-N
MW251.35 g/mol
LogP-0.72
Rot. Bonds6

About 3-[[3-aminopropyl(methyl)sulfamoyl]amino]-2-methyloxolane

3-[[3-aminopropyl(methyl)sulfamoyl]amino]-2-methyloxolane (PubChem CID 82726272) has the molecular formula C9H21N3O3S and a molecular weight of 251.35 g/mol. Its IUPAC name is 3-[[3-aminopropyl(methyl)sulfamoyl]amino]-2-methyloxolane.

Molecular Properties

Compound Name3-[[3-aminopropyl(methyl)sulfamoyl]amino]-2-methyloxolane
PubChem CID82726272
Molecular FormulaC9H21N3O3S
Molecular Weight251.35 g/mol
Exact Mass251.13
IUPAC Name3-[[3-aminopropyl(methyl)sulfamoyl]amino]-2-methyloxolane
SMILESCC1OCCC1NS(=O)(=O)N(C)CCCN
InChIInChI=1S/C9H21N3O3S/c1-8-9(4-7-15-8)11-16(13,14)12(2)6-3-5-10/h8-9,11H,3-7,10H2,1-2H3
InChIKeyFPYATPWSRUDSJO-UHFFFAOYSA-N
XLogP-0.72
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.35
LogP ≤ 5-0.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-[[3-aminopropyl(methyl)sulfamoyl]amino]-2-methyloxolane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[[3-aminopropyl(methyl)sulfamoyl]amino]oxolane
CID 80716322
1-[[3-aminopropyl(methyl)sulfamoyl]amino]-4-methylsulfanylcyclohexane
CID 114142578
N'-methyl-N'-(2-methyloxolan-3-yl)propane-1,3-diamine
CID 82718003
2-methyl-3-[[[methyl-[3-(methylamino)propyl]sulfamoyl]amino]methyl]oxolane
CID 114106932
N'-methyl-N'-[methyl(oxan-2-ylmethyl)sulfamoyl]propane-1,3-diamine
CID 54951890
(1R,2S,3R)-1-[[butyl(methyl)sulfamoyl]amino]-2,3-dimethylcyclohexane
CID 99849696
2-[[3-aminopropyl(methyl)sulfamoyl]amino]ethylcyclopentane
CID 54952302
1-(3-aminopropyl)-3,5-dimethyl-N-(2-methyloxolan-3-yl)pyrazole-4-sulfonamide
CID 106076320
2-[(2-methyloxolan-3-yl)sulfamoyl]ethanethioamide
CID 82728589
N'-[cyclopentylmethyl(methyl)sulfamoyl]-N'-methylpropane-1,3-diamine
CID 63630912
4-(2-methyloxolan-3-yl)sulfonylbutan-1-amine
CID 107756941
5-amino-N,2-dimethyl-N-(2-methyloxolan-3-yl)pentanamide
CID 104685498

Frequently Asked Questions

What is the IUPAC name of 3-[[3-aminopropyl(methyl)sulfamoyl]amino]-2-methyloxolane?
The IUPAC name of 3-[[3-aminopropyl(methyl)sulfamoyl]amino]-2-methyloxolane (CID 82726272) is 3-[[3-aminopropyl(methyl)sulfamoyl]amino]-2-methyloxolane.
What is the SMILES notation for 3-[[3-aminopropyl(methyl)sulfamoyl]amino]-2-methyloxolane?
The canonical SMILES for 3-[[3-aminopropyl(methyl)sulfamoyl]amino]-2-methyloxolane is CC1OCCC1NS(=O)(=O)N(C)CCCN.
What is the InChIKey of 3-[[3-aminopropyl(methyl)sulfamoyl]amino]-2-methyloxolane?
The InChIKey is FPYATPWSRUDSJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3O3S/c1-8-9(4-7-15-8)11-16(13,14)12(2)6-3-5-10/h8-9,11H,3-7,10H2,1-2H3.
What are the key properties of 3-[[3-aminopropyl(methyl)sulfamoyl]amino]-2-methyloxolane?
3-[[3-aminopropyl(methyl)sulfamoyl]amino]-2-methyloxolane has a molecular weight of 251.35 g/mol, XLogP of -0.72, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[3-aminopropyl(methyl)sulfamoyl]amino]-2-methyloxolane is sourced from PubChem (CID 82726272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).