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

C5H15N3O2S — CID 114803661

IUPAC2-methyl-2-N-(methylsulfamoyl)propane-1,2-diamine
SMILESCNS(=O)(=O)NC(C)(C)CN
InChIInChI=1S/C5H15N3O2S/c1-5(2,4-6)8-11(9,10)7-3/h7-8H,4,6H2,1-3H3
InChIKeyWRFAKBLYRSDABN-UHFFFAOYSA-N
MW181.26 g/mol
LogP-1.22
Rot. Bonds4

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

2-methyl-2-N-(methylsulfamoyl)propane-1,2-diamine (PubChem CID 114803661) has the molecular formula C5H15N3O2S and a molecular weight of 181.26 g/mol. Its IUPAC name is 2-methyl-2-N-(methylsulfamoyl)propane-1,2-diamine.

Molecular Properties

Compound Name2-methyl-2-N-(methylsulfamoyl)propane-1,2-diamine
PubChem CID114803661
Molecular FormulaC5H15N3O2S
Molecular Weight181.26 g/mol
Exact Mass181.09
IUPAC Name2-methyl-2-N-(methylsulfamoyl)propane-1,2-diamine
SMILESCNS(=O)(=O)NC(C)(C)CN
InChIInChI=1S/C5H15N3O2S/c1-5(2,4-6)8-11(9,10)7-3/h7-8H,4,6H2,1-3H3
InChIKeyWRFAKBLYRSDABN-UHFFFAOYSA-N
XLogP-1.22
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.26
LogP ≤ 5-1.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(Tert-butylsulfamoyl)amine
CID 22912806
N-(1-amino-2-methylpropan-2-yl)methanesulfonamide hydrochloride
CID 54592675
N-(2-amino-2-methylpropyl)methanesulfonamide hydrochloride
CID 137838148
(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-(methylsulfamoyl)propan-1-amine
CID 84282192
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
N-methyl-N'-isopropylsulfamide
CID 13269121

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-N-(methylsulfamoyl)propane-1,2-diamine?
The IUPAC name of 2-methyl-2-N-(methylsulfamoyl)propane-1,2-diamine (CID 114803661) is 2-methyl-2-N-(methylsulfamoyl)propane-1,2-diamine.
What is the SMILES notation for 2-methyl-2-N-(methylsulfamoyl)propane-1,2-diamine?
The canonical SMILES for 2-methyl-2-N-(methylsulfamoyl)propane-1,2-diamine is CNS(=O)(=O)NC(C)(C)CN.
What is the InChIKey of 2-methyl-2-N-(methylsulfamoyl)propane-1,2-diamine?
The InChIKey is WRFAKBLYRSDABN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H15N3O2S/c1-5(2,4-6)8-11(9,10)7-3/h7-8H,4,6H2,1-3H3.
What are the key properties of 2-methyl-2-N-(methylsulfamoyl)propane-1,2-diamine?
2-methyl-2-N-(methylsulfamoyl)propane-1,2-diamine has a molecular weight of 181.26 g/mol, XLogP of -1.22, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-N-(methylsulfamoyl)propane-1,2-diamine is sourced from PubChem (CID 114803661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).