2-methyl-2-N-(propylsulfamoyl)propane-1,2-diamine

C7H19N3O2S — CID 114803660

IUPAC2-methyl-2-N-(propylsulfamoyl)propane-1,2-diamine
SMILESCCCNS(=O)(=O)NC(C)(C)CN
InChIInChI=1S/C7H19N3O2S/c1-4-5-9-13(11,12)10-7(2,3)6-8/h9-10H,4-6,8H2,1-3H3
InChIKeyQCSWTPMZEKIECL-UHFFFAOYSA-N
MW209.31 g/mol
LogP-0.44
Rot. Bonds6

About 2-methyl-2-N-(propylsulfamoyl)propane-1,2-diamine

2-methyl-2-N-(propylsulfamoyl)propane-1,2-diamine (PubChem CID 114803660) has the molecular formula C7H19N3O2S and a molecular weight of 209.31 g/mol. Its IUPAC name is 2-methyl-2-N-(propylsulfamoyl)propane-1,2-diamine.

Molecular Properties

Compound Name2-methyl-2-N-(propylsulfamoyl)propane-1,2-diamine
PubChem CID114803660
Molecular FormulaC7H19N3O2S
Molecular Weight209.31 g/mol
Exact Mass209.12
IUPAC Name2-methyl-2-N-(propylsulfamoyl)propane-1,2-diamine
SMILESCCCNS(=O)(=O)NC(C)(C)CN
InChIInChI=1S/C7H19N3O2S/c1-4-5-9-13(11,12)10-7(2,3)6-8/h9-10H,4-6,8H2,1-3H3
InChIKeyQCSWTPMZEKIECL-UHFFFAOYSA-N
XLogP-0.44
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.31
LogP ≤ 5-0.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N,N''''-Dipropylsulfamide
CID 15729847
N,N'-diisopropylsulfamide
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(2-Amino-2-methylpropyl)(sulfamoyl)amine hydrochloride
CID 137838176
3,3-Dimethyl-1lambda~6~,2,5-thiadiazolidine-1,1-dione
CID 10261248
N-(1-amino-2-methylpropan-2-yl)methanesulfonamide
CID 51975222
N-(2-amino-2-methylpropyl)methanesulfonamide
CID 54269131
2-methyl-N-(propan-2-ylsulfamoyl)butan-2-amine
CID 131863190
2-methyl-2-N-(2,2,2-trifluoroethylsulfamoyl)propane-1,2-diamine
CID 114803658
2-methyl-1-N-(2,2,2-trifluoroethylsulfamoyl)propane-1,2-diamine
CID 114811222
N-(1-amino-2-methylpropan-2-yl)sulfamoyl fluoride
CID 167736042
1,1-Dimethyl-2-[(dimethylamino)sulfonylamino]ethylamine
CID 13603865
2-methyl-N-(propan-2-ylsulfamoyl)propan-1-amine
CID 22966183

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-N-(propylsulfamoyl)propane-1,2-diamine?
The IUPAC name of 2-methyl-2-N-(propylsulfamoyl)propane-1,2-diamine (CID 114803660) is 2-methyl-2-N-(propylsulfamoyl)propane-1,2-diamine.
What is the SMILES notation for 2-methyl-2-N-(propylsulfamoyl)propane-1,2-diamine?
The canonical SMILES for 2-methyl-2-N-(propylsulfamoyl)propane-1,2-diamine is CCCNS(=O)(=O)NC(C)(C)CN.
What is the InChIKey of 2-methyl-2-N-(propylsulfamoyl)propane-1,2-diamine?
The InChIKey is QCSWTPMZEKIECL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H19N3O2S/c1-4-5-9-13(11,12)10-7(2,3)6-8/h9-10H,4-6,8H2,1-3H3.
What are the key properties of 2-methyl-2-N-(propylsulfamoyl)propane-1,2-diamine?
2-methyl-2-N-(propylsulfamoyl)propane-1,2-diamine has a molecular weight of 209.31 g/mol, XLogP of -0.44, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-N-(propylsulfamoyl)propane-1,2-diamine is sourced from PubChem (CID 114803660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).