N'-cyclopropyl-N'-(diethylsulfamoyl)propane-1,3-diamine

C10H23N3O2S — CID 43136988

IUPACN'-cyclopropyl-N'-(diethylsulfamoyl)propane-1,3-diamine
SMILESCCN(CC)S(=O)(=O)N(CCCN)C1CC1
InChIInChI=1S/C10H23N3O2S/c1-3-12(4-2)16(14,15)13(9-5-8-11)10-6-7-10/h10H,3-9,11H2,1-2H3
InChIKeyFCINHDWCGDABKB-UHFFFAOYSA-N
MW249.38 g/mol
LogP0.39
Rot. Bonds8

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

N'-cyclopropyl-N'-(diethylsulfamoyl)propane-1,3-diamine (PubChem CID 43136988) has the molecular formula C10H23N3O2S and a molecular weight of 249.38 g/mol. Its IUPAC name is N'-cyclopropyl-N'-(diethylsulfamoyl)propane-1,3-diamine.

Molecular Properties

Compound NameN'-cyclopropyl-N'-(diethylsulfamoyl)propane-1,3-diamine
PubChem CID43136988
Molecular FormulaC10H23N3O2S
Molecular Weight249.38 g/mol
Exact Mass249.15
IUPAC NameN'-cyclopropyl-N'-(diethylsulfamoyl)propane-1,3-diamine
SMILESCCN(CC)S(=O)(=O)N(CCCN)C1CC1
InChIInChI=1S/C10H23N3O2S/c1-3-12(4-2)16(14,15)13(9-5-8-11)10-6-7-10/h10H,3-9,11H2,1-2H3
InChIKeyFCINHDWCGDABKB-UHFFFAOYSA-N
XLogP0.39
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.38
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N'-cyclopropyl-N'-(diethylsulfamoyl)propane-1,3-diamine?
The IUPAC name of N'-cyclopropyl-N'-(diethylsulfamoyl)propane-1,3-diamine (CID 43136988) is N'-cyclopropyl-N'-(diethylsulfamoyl)propane-1,3-diamine.
What is the SMILES notation for N'-cyclopropyl-N'-(diethylsulfamoyl)propane-1,3-diamine?
The canonical SMILES for N'-cyclopropyl-N'-(diethylsulfamoyl)propane-1,3-diamine is CCN(CC)S(=O)(=O)N(CCCN)C1CC1.
What is the InChIKey of N'-cyclopropyl-N'-(diethylsulfamoyl)propane-1,3-diamine?
The InChIKey is FCINHDWCGDABKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O2S/c1-3-12(4-2)16(14,15)13(9-5-8-11)10-6-7-10/h10H,3-9,11H2,1-2H3.
What are the key properties of N'-cyclopropyl-N'-(diethylsulfamoyl)propane-1,3-diamine?
N'-cyclopropyl-N'-(diethylsulfamoyl)propane-1,3-diamine has a molecular weight of 249.38 g/mol, XLogP of 0.39, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopropyl-N'-(diethylsulfamoyl)propane-1,3-diamine is sourced from PubChem (CID 43136988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).