3-(aminomethyl)-3-(diethylsulfamoylamino)pentane

C10H25N3O2S — CID 61124579

IUPAC3-(aminomethyl)-3-(diethylsulfamoylamino)pentane
SMILESCCN(CC)S(=O)(=O)NC(CC)(CC)CN
InChIInChI=1S/C10H25N3O2S/c1-5-10(6-2,9-11)12-16(14,15)13(7-3)8-4/h12H,5-9,11H2,1-4H3
InChIKeyUBNSFUWRCGQNSN-UHFFFAOYSA-N
MW251.40 g/mol
LogP0.68
Rot. Bonds8

About 3-(aminomethyl)-3-(diethylsulfamoylamino)pentane

3-(aminomethyl)-3-(diethylsulfamoylamino)pentane (PubChem CID 61124579) has the molecular formula C10H25N3O2S and a molecular weight of 251.40 g/mol. Its IUPAC name is 3-(aminomethyl)-3-(diethylsulfamoylamino)pentane.

Molecular Properties

Compound Name3-(aminomethyl)-3-(diethylsulfamoylamino)pentane
PubChem CID61124579
Molecular FormulaC10H25N3O2S
Molecular Weight251.40 g/mol
Exact Mass251.17
IUPAC Name3-(aminomethyl)-3-(diethylsulfamoylamino)pentane
SMILESCCN(CC)S(=O)(=O)NC(CC)(CC)CN
InChIInChI=1S/C10H25N3O2S/c1-5-10(6-2,9-11)12-16(14,15)13(7-3)8-4/h12H,5-9,11H2,1-4H3
InChIKeyUBNSFUWRCGQNSN-UHFFFAOYSA-N
XLogP0.68
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
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

N-(2-amino-2-ethylbutyl)azepane-1-sulfonamide
CID 86814102
N-(2-amino-2-ethylbutyl)piperidine-1-sulfonamide
CID 91645913
3-Amino-3-[[[ethyl(methyl)sulfamoyl]amino]methyl]pentane
CID 91659860
1-[Butyl(2-methylbutan-2-ylsulfamoyl)amino]pentane
CID 169963894
1-[Butyl(tert-butylsulfamoyl)amino]pentane
CID 169963895
N'-tert-butyl-N'-(dimethylsulfamoyl)ethane-1,2-diamine
CID 28708159
1-(Aminomethyl)-1-(diethylsulfamoylamino)cyclohexane
CID 28940484
1-(Aminomethyl)-1-(dimethylsulfamoylamino)cyclopentane
CID 28940502
1-(Aminomethyl)-1-(diethylsulfamoylamino)cyclopentane
CID 28940522
1-Amino-1-[(diethylsulfamoylamino)methyl]cyclohexane
CID 43598190
2-Amino-1-(diethylsulfamoylamino)-4-methylpentane
CID 43606400
N'-[ethyl(2-ethylbutyl)sulfamoyl]-N'-methylpropane-1,3-diamine
CID 54952614

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-3-(diethylsulfamoylamino)pentane?
The IUPAC name of 3-(aminomethyl)-3-(diethylsulfamoylamino)pentane (CID 61124579) is 3-(aminomethyl)-3-(diethylsulfamoylamino)pentane.
What is the SMILES notation for 3-(aminomethyl)-3-(diethylsulfamoylamino)pentane?
The canonical SMILES for 3-(aminomethyl)-3-(diethylsulfamoylamino)pentane is CCN(CC)S(=O)(=O)NC(CC)(CC)CN.
What is the InChIKey of 3-(aminomethyl)-3-(diethylsulfamoylamino)pentane?
The InChIKey is UBNSFUWRCGQNSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H25N3O2S/c1-5-10(6-2,9-11)12-16(14,15)13(7-3)8-4/h12H,5-9,11H2,1-4H3.
What are the key properties of 3-(aminomethyl)-3-(diethylsulfamoylamino)pentane?
3-(aminomethyl)-3-(diethylsulfamoylamino)pentane has a molecular weight of 251.40 g/mol, XLogP of 0.68, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-3-(diethylsulfamoylamino)pentane is sourced from PubChem (CID 61124579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).