1-cyclopropyl-N-(methylsulfamoyl)ethane-1,2-diamine

C6H15N3O2S — CID 114804059

IUPAC1-cyclopropyl-N-(methylsulfamoyl)ethane-1,2-diamine
SMILESCNS(=O)(=O)NC(CN)C1CC1
InChIInChI=1S/C6H15N3O2S/c1-8-12(10,11)9-6(4-7)5-2-3-5/h5-6,8-9H,2-4,7H2,1H3
InChIKeyBPLOPTSNEKGMKX-UHFFFAOYSA-N
MW193.27 g/mol
LogP-1.22
Rot. Bonds5

About 1-cyclopropyl-N-(methylsulfamoyl)ethane-1,2-diamine

1-cyclopropyl-N-(methylsulfamoyl)ethane-1,2-diamine (PubChem CID 114804059) has the molecular formula C6H15N3O2S and a molecular weight of 193.27 g/mol. Its IUPAC name is 1-cyclopropyl-N-(methylsulfamoyl)ethane-1,2-diamine.

Molecular Properties

Compound Name1-cyclopropyl-N-(methylsulfamoyl)ethane-1,2-diamine
PubChem CID114804059
Molecular FormulaC6H15N3O2S
Molecular Weight193.27 g/mol
Exact Mass193.09
IUPAC Name1-cyclopropyl-N-(methylsulfamoyl)ethane-1,2-diamine
SMILESCNS(=O)(=O)NC(CN)C1CC1
InChIInChI=1S/C6H15N3O2S/c1-8-12(10,11)9-6(4-7)5-2-3-5/h5-6,8-9H,2-4,7H2,1H3
InChIKeyBPLOPTSNEKGMKX-UHFFFAOYSA-N
XLogP-1.22
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.27
LogP ≤ 5-1.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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N-(2-amino-1-cyclohexylethyl)cyclopropanesulfonamide
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ethyl 2-[(2-amino-1-cyclopropylethyl)sulfamoyl]acetate
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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-(methylsulfamoyl)ethane-1,2-diamine?
The IUPAC name of 1-cyclopropyl-N-(methylsulfamoyl)ethane-1,2-diamine (CID 114804059) is 1-cyclopropyl-N-(methylsulfamoyl)ethane-1,2-diamine.
What is the SMILES notation for 1-cyclopropyl-N-(methylsulfamoyl)ethane-1,2-diamine?
The canonical SMILES for 1-cyclopropyl-N-(methylsulfamoyl)ethane-1,2-diamine is CNS(=O)(=O)NC(CN)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-(methylsulfamoyl)ethane-1,2-diamine?
The InChIKey is BPLOPTSNEKGMKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15N3O2S/c1-8-12(10,11)9-6(4-7)5-2-3-5/h5-6,8-9H,2-4,7H2,1H3.
What are the key properties of 1-cyclopropyl-N-(methylsulfamoyl)ethane-1,2-diamine?
1-cyclopropyl-N-(methylsulfamoyl)ethane-1,2-diamine has a molecular weight of 193.27 g/mol, XLogP of -1.22, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-(methylsulfamoyl)ethane-1,2-diamine is sourced from PubChem (CID 114804059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).