1-amino-3,3-dimethyl-5-[methyl(sulfamoyl)amino]pentane

C8H21N3O2S — CID 141231013

IUPAC1-amino-3,3-dimethyl-5-[methyl(sulfamoyl)amino]pentane
SMILESCN(CCC(C)(C)CCN)S(N)(=O)=O
InChIInChI=1S/C8H21N3O2S/c1-8(2,4-6-9)5-7-11(3)14(10,12)13/h4-7,9H2,1-3H3,(H2,10,12,13)
InChIKeyURSULEGSFSQLHX-UHFFFAOYSA-N
MW223.34 g/mol
LogP-0.11
Rot. Bonds6

About 1-amino-3,3-dimethyl-5-[methyl(sulfamoyl)amino]pentane

1-amino-3,3-dimethyl-5-[methyl(sulfamoyl)amino]pentane (PubChem CID 141231013) has the molecular formula C8H21N3O2S and a molecular weight of 223.34 g/mol. Its IUPAC name is 1-amino-3,3-dimethyl-5-[methyl(sulfamoyl)amino]pentane.

Molecular Properties

Compound Name1-amino-3,3-dimethyl-5-[methyl(sulfamoyl)amino]pentane
PubChem CID141231013
Molecular FormulaC8H21N3O2S
Molecular Weight223.34 g/mol
Exact Mass223.14
IUPAC Name1-amino-3,3-dimethyl-5-[methyl(sulfamoyl)amino]pentane
SMILESCN(CCC(C)(C)CCN)S(N)(=O)=O
InChIInChI=1S/C8H21N3O2S/c1-8(2,4-6-9)5-7-11(3)14(10,12)13/h4-7,9H2,1-3H3,(H2,10,12,13)
InChIKeyURSULEGSFSQLHX-UHFFFAOYSA-N
XLogP-0.11
TPSA89.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.34
LogP ≤ 5-0.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,3,4,4-tetramethyl-N-(methylsulfamoyl)pentan-1-amine
CID 20706577
1-(Dimethylsulfamoylamino)-4-methylpentane
CID 21021023
3-[(Dimethylsulfamoylamino)methyl]-2,2,4-trimethylpentane
CID 58124476
N,4,4-trimethylpiperidine-1-sulfonamide
CID 67128610
1-(Dimethylsulfamoylamino)-3,3-dimethylbutane
CID 89148999
4,4-dimethyl-N-(methylsulfamoyl)pentan-1-amine
CID 110611315
3-Methyl-1-(methylamino)-5-(sulfamoylamino)pentane
CID 155135891
1-(Dimethylsulfamoylamino)-4,4-dimethylpentane
CID 172137882
N'-[ethyl(2-ethylbutyl)sulfamoyl]-N'-methylpropane-1,3-diamine
CID 54952614
N-(3-aminopropyl)-N,4,4-trimethylpiperidine-1-sulfonamide
CID 55156700
1-[[[3-Aminopropyl(methyl)sulfamoyl]amino]methyl]-1-methylcyclopentane
CID 55261018
2-[[3-Aminopropyl(methyl)sulfamoyl]amino]-2,4,4-trimethylpentane
CID 61666792

Frequently Asked Questions

What is the IUPAC name of 1-amino-3,3-dimethyl-5-[methyl(sulfamoyl)amino]pentane?
The IUPAC name of 1-amino-3,3-dimethyl-5-[methyl(sulfamoyl)amino]pentane (CID 141231013) is 1-amino-3,3-dimethyl-5-[methyl(sulfamoyl)amino]pentane.
What is the SMILES notation for 1-amino-3,3-dimethyl-5-[methyl(sulfamoyl)amino]pentane?
The canonical SMILES for 1-amino-3,3-dimethyl-5-[methyl(sulfamoyl)amino]pentane is CN(CCC(C)(C)CCN)S(N)(=O)=O.
What is the InChIKey of 1-amino-3,3-dimethyl-5-[methyl(sulfamoyl)amino]pentane?
The InChIKey is URSULEGSFSQLHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H21N3O2S/c1-8(2,4-6-9)5-7-11(3)14(10,12)13/h4-7,9H2,1-3H3,(H2,10,12,13).
What are the key properties of 1-amino-3,3-dimethyl-5-[methyl(sulfamoyl)amino]pentane?
1-amino-3,3-dimethyl-5-[methyl(sulfamoyl)amino]pentane has a molecular weight of 223.34 g/mol, XLogP of -0.11, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3,3-dimethyl-5-[methyl(sulfamoyl)amino]pentane is sourced from PubChem (CID 141231013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).