N'-(diethylsulfamoyl)-N'-(2-methoxyethyl)propane-1,3-diamine

C10H25N3O3S — CID 55171129

IUPACN'-(diethylsulfamoyl)-N'-(2-methoxyethyl)propane-1,3-diamine
SMILESCCN(CC)S(=O)(=O)N(CCCN)CCOC
InChIInChI=1S/C10H25N3O3S/c1-4-12(5-2)17(14,15)13(8-6-7-11)9-10-16-3/h4-11H2,1-3H3
InChIKeySDJPBWATQLGHCB-UHFFFAOYSA-N
MW267.39 g/mol
LogP-0.13
Rot. Bonds10

About N'-(diethylsulfamoyl)-N'-(2-methoxyethyl)propane-1,3-diamine

N'-(diethylsulfamoyl)-N'-(2-methoxyethyl)propane-1,3-diamine (PubChem CID 55171129) has the molecular formula C10H25N3O3S and a molecular weight of 267.39 g/mol. Its IUPAC name is N'-(diethylsulfamoyl)-N'-(2-methoxyethyl)propane-1,3-diamine.

Molecular Properties

Compound NameN'-(diethylsulfamoyl)-N'-(2-methoxyethyl)propane-1,3-diamine
PubChem CID55171129
Molecular FormulaC10H25N3O3S
Molecular Weight267.39 g/mol
Exact Mass267.16
IUPAC NameN'-(diethylsulfamoyl)-N'-(2-methoxyethyl)propane-1,3-diamine
SMILESCCN(CC)S(=O)(=O)N(CCCN)CCOC
InChIInChI=1S/C10H25N3O3S/c1-4-12(5-2)17(14,15)13(8-6-7-11)9-10-16-3/h4-11H2,1-3H3
InChIKeySDJPBWATQLGHCB-UHFFFAOYSA-N
XLogP-0.13
TPSA75.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.39
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N'-(diethylsulfamoyl)-N'-(2-methoxyethyl)propane-1,3-diamine?
The IUPAC name of N'-(diethylsulfamoyl)-N'-(2-methoxyethyl)propane-1,3-diamine (CID 55171129) is N'-(diethylsulfamoyl)-N'-(2-methoxyethyl)propane-1,3-diamine.
What is the SMILES notation for N'-(diethylsulfamoyl)-N'-(2-methoxyethyl)propane-1,3-diamine?
The canonical SMILES for N'-(diethylsulfamoyl)-N'-(2-methoxyethyl)propane-1,3-diamine is CCN(CC)S(=O)(=O)N(CCCN)CCOC.
What is the InChIKey of N'-(diethylsulfamoyl)-N'-(2-methoxyethyl)propane-1,3-diamine?
The InChIKey is SDJPBWATQLGHCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H25N3O3S/c1-4-12(5-2)17(14,15)13(8-6-7-11)9-10-16-3/h4-11H2,1-3H3.
What are the key properties of N'-(diethylsulfamoyl)-N'-(2-methoxyethyl)propane-1,3-diamine?
N'-(diethylsulfamoyl)-N'-(2-methoxyethyl)propane-1,3-diamine has a molecular weight of 267.39 g/mol, XLogP of -0.13, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(diethylsulfamoyl)-N'-(2-methoxyethyl)propane-1,3-diamine is sourced from PubChem (CID 55171129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).