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

C9H23N3O2S — CID 61456420

IUPAC2-[[3-aminopropyl(methyl)sulfamoyl]amino]pentane
SMILESCCCC(C)NS(=O)(=O)N(C)CCCN
InChIInChI=1S/C9H23N3O2S/c1-4-6-9(2)11-15(13,14)12(3)8-5-7-10/h9,11H,4-8,10H2,1-3H3
InChIKeyGPEVQMAEKDKKTQ-UHFFFAOYSA-N
MW237.37 g/mol
LogP0.29
Rot. Bonds8

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

2-[[3-aminopropyl(methyl)sulfamoyl]amino]pentane (PubChem CID 61456420) has the molecular formula C9H23N3O2S and a molecular weight of 237.37 g/mol. Its IUPAC name is 2-[[3-aminopropyl(methyl)sulfamoyl]amino]pentane.

Molecular Properties

Compound Name2-[[3-aminopropyl(methyl)sulfamoyl]amino]pentane
PubChem CID61456420
Molecular FormulaC9H23N3O2S
Molecular Weight237.37 g/mol
Exact Mass237.15
IUPAC Name2-[[3-aminopropyl(methyl)sulfamoyl]amino]pentane
SMILESCCCC(C)NS(=O)(=O)N(C)CCCN
InChIInChI=1S/C9H23N3O2S/c1-4-6-9(2)11-15(13,14)12(3)8-5-7-10/h9,11H,4-8,10H2,1-3H3
InChIKeyGPEVQMAEKDKKTQ-UHFFFAOYSA-N
XLogP0.29
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.37
LogP ≤ 50.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[3-aminopropyl(methyl)sulfamoyl]amino]hexane
CID 62200403
2-[[3-aminopropyl(methyl)sulfamoyl]amino]-4-methylpentane
CID 61456363
[3-[methyl(pentan-2-ylsulfamoyl)amino]propylamino]cyclopropane
CID 106046227
2-(dimethylsulfamoylamino)pentane
CID 4635587
2-[[3-aminopropyl(methyl)sulfamoyl]amino]-N-ethylpropanamide
CID 54952297
2-[[butyl(methyl)sulfamoyl]amino]-1-hydroxy-3-methylbutane
CID 79256341
(2S)-2-[[butyl(methyl)sulfamoyl]amino]-1-hydroxy-3-methylbutane
CID 79256086
2-[3-aminopropyl(propan-2-yl)amino]-N-pentan-2-ylpropanamide
CID 43137419
2-[1-[[3-aminopropyl(methyl)sulfamoyl]amino]ethyl]pyridine
CID 54952613
N'-methyl-N'-pentan-2-ylpropane-1,3-diamine
CID 43571779
3-amino-1-[[butyl(methyl)sulfamoyl]amino]butane
CID 63251281
2-[[3-aminopropyl(methyl)sulfamoyl]amino]-N-propylacetamide
CID 54952091

Frequently Asked Questions

What is the IUPAC name of 2-[[3-aminopropyl(methyl)sulfamoyl]amino]pentane?
The IUPAC name of 2-[[3-aminopropyl(methyl)sulfamoyl]amino]pentane (CID 61456420) is 2-[[3-aminopropyl(methyl)sulfamoyl]amino]pentane.
What is the SMILES notation for 2-[[3-aminopropyl(methyl)sulfamoyl]amino]pentane?
The canonical SMILES for 2-[[3-aminopropyl(methyl)sulfamoyl]amino]pentane is CCCC(C)NS(=O)(=O)N(C)CCCN.
What is the InChIKey of 2-[[3-aminopropyl(methyl)sulfamoyl]amino]pentane?
The InChIKey is GPEVQMAEKDKKTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H23N3O2S/c1-4-6-9(2)11-15(13,14)12(3)8-5-7-10/h9,11H,4-8,10H2,1-3H3.
What are the key properties of 2-[[3-aminopropyl(methyl)sulfamoyl]amino]pentane?
2-[[3-aminopropyl(methyl)sulfamoyl]amino]pentane has a molecular weight of 237.37 g/mol, XLogP of 0.29, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[3-aminopropyl(methyl)sulfamoyl]amino]pentane is sourced from PubChem (CID 61456420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).