[2-aminoethylsulfamoyl(methyl)amino]methylcyclopropane;hydrochloride

C7H18ClN3O2S — CID 119959979

IUPAC[2-aminoethylsulfamoyl(methyl)amino]methylcyclopropane;hydrochloride
SMILESCN(CC1CC1)S(=O)(=O)NCCN.Cl
InChIInChI=1S/C7H17N3O2S.ClH/c1-10(6-7-2-3-7)13(11,12)9-5-4-8;/h7,9H,2-6,8H2,1H3;1H
InChIKeyKDWAGICDKJYVGA-UHFFFAOYSA-N
MW243.76 g/mol
LogP-0.46
Rot. Bonds6

About [2-aminoethylsulfamoyl(methyl)amino]methylcyclopropane;hydrochloride

[2-aminoethylsulfamoyl(methyl)amino]methylcyclopropane;hydrochloride (PubChem CID 119959979) has the molecular formula C7H18ClN3O2S and a molecular weight of 243.76 g/mol. Its IUPAC name is [2-aminoethylsulfamoyl(methyl)amino]methylcyclopropane;hydrochloride.

Molecular Properties

Compound Name[2-aminoethylsulfamoyl(methyl)amino]methylcyclopropane;hydrochloride
PubChem CID119959979
Molecular FormulaC7H18ClN3O2S
Molecular Weight243.76 g/mol
Exact Mass243.08
IUPAC Name[2-aminoethylsulfamoyl(methyl)amino]methylcyclopropane;hydrochloride
SMILESCN(CC1CC1)S(=O)(=O)NCCN.Cl
InChIInChI=1S/C7H17N3O2S.ClH/c1-10(6-7-2-3-7)13(11,12)9-5-4-8;/h7,9H,2-6,8H2,1H3;1H
InChIKeyKDWAGICDKJYVGA-UHFFFAOYSA-N
XLogP-0.46
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.76
LogP ≤ 5-0.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-aminoethylsulfamoyl(methyl)amino]methylcyclopropane;hydrochloride?
The IUPAC name of [2-aminoethylsulfamoyl(methyl)amino]methylcyclopropane;hydrochloride (CID 119959979) is [2-aminoethylsulfamoyl(methyl)amino]methylcyclopropane;hydrochloride.
What is the SMILES notation for [2-aminoethylsulfamoyl(methyl)amino]methylcyclopropane;hydrochloride?
The canonical SMILES for [2-aminoethylsulfamoyl(methyl)amino]methylcyclopropane;hydrochloride is CN(CC1CC1)S(=O)(=O)NCCN.Cl.
What is the InChIKey of [2-aminoethylsulfamoyl(methyl)amino]methylcyclopropane;hydrochloride?
The InChIKey is KDWAGICDKJYVGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N3O2S.ClH/c1-10(6-7-2-3-7)13(11,12)9-5-4-8;/h7,9H,2-6,8H2,1H3;1H.
What are the key properties of [2-aminoethylsulfamoyl(methyl)amino]methylcyclopropane;hydrochloride?
[2-aminoethylsulfamoyl(methyl)amino]methylcyclopropane;hydrochloride has a molecular weight of 243.76 g/mol, XLogP of -0.46, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-aminoethylsulfamoyl(methyl)amino]methylcyclopropane;hydrochloride is sourced from PubChem (CID 119959979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).