1-amino-2,4-dimethyl-2-(sulfamoylamino)pentane

C7H19N3O2S — CID 114959433

IUPAC1-amino-2,4-dimethyl-2-(sulfamoylamino)pentane
SMILESCC(C)CC(C)(CN)NS(N)(=O)=O
InChIInChI=1S/C7H19N3O2S/c1-6(2)4-7(3,5-8)10-13(9,11)12/h6,10H,4-5,8H2,1-3H3,(H2,9,11,12)
InChIKeyDVHPHXGRKXACIA-UHFFFAOYSA-N
MW209.31 g/mol
LogP-0.46
Rot. Bonds5

About 1-amino-2,4-dimethyl-2-(sulfamoylamino)pentane

1-amino-2,4-dimethyl-2-(sulfamoylamino)pentane (PubChem CID 114959433) has the molecular formula C7H19N3O2S and a molecular weight of 209.31 g/mol. Its IUPAC name is 1-amino-2,4-dimethyl-2-(sulfamoylamino)pentane.

Molecular Properties

Compound Name1-amino-2,4-dimethyl-2-(sulfamoylamino)pentane
PubChem CID114959433
Molecular FormulaC7H19N3O2S
Molecular Weight209.31 g/mol
Exact Mass209.12
IUPAC Name1-amino-2,4-dimethyl-2-(sulfamoylamino)pentane
SMILESCC(C)CC(C)(CN)NS(N)(=O)=O
InChIInChI=1S/C7H19N3O2S/c1-6(2)4-7(3,5-8)10-13(9,11)12/h6,10H,4-5,8H2,1-3H3,(H2,9,11,12)
InChIKeyDVHPHXGRKXACIA-UHFFFAOYSA-N
XLogP-0.46
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.31
LogP ≤ 5-0.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-dimethyl-2-N-(methylsulfamoyl)pentane-1,2-diamine
CID 114811263
N-[(2R)-1-amino-2,4-dimethylpentan-2-yl]methanesulfonamide
CID 97237986
N-(1-amino-2,4-dimethylpentan-2-yl)ethanesulfonamide;hydrochloride
CID 119985245
1-amino-2,4-dimethyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane;hydrochloride
CID 119985049
N-(1-amino-2,4-dimethylpentan-2-yl)benzenesulfonamide;hydrochloride
CID 84591010
N-(1-amino-2,4-dimethylpentan-2-yl)-2-methylpentane-1-sulfonamide;hydrochloride
CID 119985236
N-(1-amino-2,4-dimethylpentan-2-yl)-1-phenylmethanesulfonamide
CID 115309921
N-(1-amino-2,4-dimethylpentan-2-yl)-2,4,5-trifluorobenzenesulfonamide
CID 119985170
3-N-(1-amino-2,4-dimethylpentan-2-yl)benzene-1,3-disulfonamide;hydrochloride
CID 119985204
ethyl 3-[(1-amino-2,4-dimethylpentan-2-yl)sulfamoyl]propanoate
CID 115310020
N-(1-amino-2,4-dimethylpentan-2-yl)-2,4,6-trichlorobenzenesulfonamide
CID 115310018
2,4-dimethyl-2-N-propan-2-ylpentane-1,2-diamine
CID 62066796

Frequently Asked Questions

What is the IUPAC name of 1-amino-2,4-dimethyl-2-(sulfamoylamino)pentane?
The IUPAC name of 1-amino-2,4-dimethyl-2-(sulfamoylamino)pentane (CID 114959433) is 1-amino-2,4-dimethyl-2-(sulfamoylamino)pentane.
What is the SMILES notation for 1-amino-2,4-dimethyl-2-(sulfamoylamino)pentane?
The canonical SMILES for 1-amino-2,4-dimethyl-2-(sulfamoylamino)pentane is CC(C)CC(C)(CN)NS(N)(=O)=O.
What is the InChIKey of 1-amino-2,4-dimethyl-2-(sulfamoylamino)pentane?
The InChIKey is DVHPHXGRKXACIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H19N3O2S/c1-6(2)4-7(3,5-8)10-13(9,11)12/h6,10H,4-5,8H2,1-3H3,(H2,9,11,12).
What are the key properties of 1-amino-2,4-dimethyl-2-(sulfamoylamino)pentane?
1-amino-2,4-dimethyl-2-(sulfamoylamino)pentane has a molecular weight of 209.31 g/mol, XLogP of -0.46, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2,4-dimethyl-2-(sulfamoylamino)pentane is sourced from PubChem (CID 114959433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).