3-(aminomethyl)-3-[methyl(propan-2-ylsulfamoyl)amino]pentane

C10H25N3O2S — CID 114803908

IUPAC3-(aminomethyl)-3-[methyl(propan-2-ylsulfamoyl)amino]pentane
SMILESCCC(CC)(CN)N(C)S(=O)(=O)NC(C)C
InChIInChI=1S/C10H25N3O2S/c1-6-10(7-2,8-11)13(5)16(14,15)12-9(3)4/h9,12H,6-8,11H2,1-5H3
InChIKeyUSFIFBKFYQNQAE-UHFFFAOYSA-N
MW251.40 g/mol
LogP0.68
Rot. Bonds7

About 3-(aminomethyl)-3-[methyl(propan-2-ylsulfamoyl)amino]pentane

3-(aminomethyl)-3-[methyl(propan-2-ylsulfamoyl)amino]pentane (PubChem CID 114803908) has the molecular formula C10H25N3O2S and a molecular weight of 251.40 g/mol. Its IUPAC name is 3-(aminomethyl)-3-[methyl(propan-2-ylsulfamoyl)amino]pentane.

Molecular Properties

Compound Name3-(aminomethyl)-3-[methyl(propan-2-ylsulfamoyl)amino]pentane
PubChem CID114803908
Molecular FormulaC10H25N3O2S
Molecular Weight251.40 g/mol
Exact Mass251.17
IUPAC Name3-(aminomethyl)-3-[methyl(propan-2-ylsulfamoyl)amino]pentane
SMILESCCC(CC)(CN)N(C)S(=O)(=O)NC(C)C
InChIInChI=1S/C10H25N3O2S/c1-6-10(7-2,8-11)13(5)16(14,15)12-9(3)4/h9,12H,6-8,11H2,1-5H3
InChIKeyUSFIFBKFYQNQAE-UHFFFAOYSA-N
XLogP0.68
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.40
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(aminomethyl)-3-[methyl(methylsulfamoyl)amino]pentane
CID 114803911
N-[3-(aminomethyl)pentan-3-yl]-N,2-dimethylpropane-2-sulfonamide
CID 63687287
N-[3-(aminomethyl)pentan-3-yl]-N-methyl-2-methylsulfonylethanesulfonamide
CID 63245031
N-[3-(aminomethyl)pentan-3-yl]-N,4-dimethylbenzenesulfonamide
CID 62008652
1-[propan-2-ylsulfamoyl(propyl)amino]propane
CID 60750604
2-[tert-butyl(propan-2-ylsulfamoyl)amino]-2-methylpropane
CID 58613885
N-[3-(aminomethyl)pentan-3-yl]-N-ethylethanesulfonamide
CID 62008453
1-[3-(aminomethyl)pentan-3-yl-methylamino]propan-2-ol
CID 65277906
N-[3-(aminomethyl)pentan-3-yl]-N,3-dimethylpiperidine-1-sulfonamide
CID 62009652
N-[3-(aminomethyl)pentan-3-yl]-N-methyl-2-phenylethanesulfonamide
CID 80686528
[[3-(aminomethyl)pentan-3-yl-ethylsulfamoyl]amino]cyclopropane
CID 114803918
2-[3-(aminomethyl)pentan-3-yl-ethylamino]-N-methyl-N-propan-2-ylacetamide
CID 62010606

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-3-[methyl(propan-2-ylsulfamoyl)amino]pentane?
The IUPAC name of 3-(aminomethyl)-3-[methyl(propan-2-ylsulfamoyl)amino]pentane (CID 114803908) is 3-(aminomethyl)-3-[methyl(propan-2-ylsulfamoyl)amino]pentane.
What is the SMILES notation for 3-(aminomethyl)-3-[methyl(propan-2-ylsulfamoyl)amino]pentane?
The canonical SMILES for 3-(aminomethyl)-3-[methyl(propan-2-ylsulfamoyl)amino]pentane is CCC(CC)(CN)N(C)S(=O)(=O)NC(C)C.
What is the InChIKey of 3-(aminomethyl)-3-[methyl(propan-2-ylsulfamoyl)amino]pentane?
The InChIKey is USFIFBKFYQNQAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H25N3O2S/c1-6-10(7-2,8-11)13(5)16(14,15)12-9(3)4/h9,12H,6-8,11H2,1-5H3.
What are the key properties of 3-(aminomethyl)-3-[methyl(propan-2-ylsulfamoyl)amino]pentane?
3-(aminomethyl)-3-[methyl(propan-2-ylsulfamoyl)amino]pentane has a molecular weight of 251.40 g/mol, XLogP of 0.68, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-3-[methyl(propan-2-ylsulfamoyl)amino]pentane is sourced from PubChem (CID 114803908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).