1-amino-2,4-dimethyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane;hydrochloride

C11H28ClN3O2S — CID 119985049

IUPAC1-amino-2,4-dimethyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane;hydrochloride
SMILESCC(C)CC(C)(CN)NS(=O)(=O)N(C)C(C)C.Cl
InChIInChI=1S/C11H27N3O2S.ClH/c1-9(2)7-11(5,8-12)13-17(15,16)14(6)10(3)4;/h9-10,13H,7-8,12H2,1-6H3;1H
InChIKeyOTVNNRAXTFIDQA-UHFFFAOYSA-N
MW301.88 g/mol
LogP1.35
Rot. Bonds7

About 1-amino-2,4-dimethyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane;hydrochloride

1-amino-2,4-dimethyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane;hydrochloride (PubChem CID 119985049) has the molecular formula C11H28ClN3O2S and a molecular weight of 301.88 g/mol. Its IUPAC name is 1-amino-2,4-dimethyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane;hydrochloride.

Molecular Properties

Compound Name1-amino-2,4-dimethyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane;hydrochloride
PubChem CID119985049
Molecular FormulaC11H28ClN3O2S
Molecular Weight301.88 g/mol
Exact Mass301.16
IUPAC Name1-amino-2,4-dimethyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane;hydrochloride
SMILESCC(C)CC(C)(CN)NS(=O)(=O)N(C)C(C)C.Cl
InChIInChI=1S/C11H27N3O2S.ClH/c1-9(2)7-11(5,8-12)13-17(15,16)14(6)10(3)4;/h9-10,13H,7-8,12H2,1-6H3;1H
InChIKeyOTVNNRAXTFIDQA-UHFFFAOYSA-N
XLogP1.35
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.88
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-amino-2,4-dimethyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane;hydrochloride?
The IUPAC name of 1-amino-2,4-dimethyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane;hydrochloride (CID 119985049) is 1-amino-2,4-dimethyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane;hydrochloride.
What is the SMILES notation for 1-amino-2,4-dimethyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane;hydrochloride?
The canonical SMILES for 1-amino-2,4-dimethyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane;hydrochloride is CC(C)CC(C)(CN)NS(=O)(=O)N(C)C(C)C.Cl.
What is the InChIKey of 1-amino-2,4-dimethyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane;hydrochloride?
The InChIKey is OTVNNRAXTFIDQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H27N3O2S.ClH/c1-9(2)7-11(5,8-12)13-17(15,16)14(6)10(3)4;/h9-10,13H,7-8,12H2,1-6H3;1H.
What are the key properties of 1-amino-2,4-dimethyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane;hydrochloride?
1-amino-2,4-dimethyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane;hydrochloride has a molecular weight of 301.88 g/mol, XLogP of 1.35, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2,4-dimethyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane;hydrochloride is sourced from PubChem (CID 119985049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).