1-(aminomethyl)-1-[ethyl(sulfamoyl)amino]cyclopentane

C8H19N3O2S — CID 114958602

IUPAC1-(aminomethyl)-1-[ethyl(sulfamoyl)amino]cyclopentane
SMILESCCN(C1(CN)CCCC1)S(N)(=O)=O
InChIInChI=1S/C8H19N3O2S/c1-2-11(14(10,12)13)8(7-9)5-3-4-6-8/h2-7,9H2,1H3,(H2,10,12,13)
InChIKeyVQZGPKCIYZVITI-UHFFFAOYSA-N
MW221.33 g/mol
LogP-0.22
Rot. Bonds4

About 1-(aminomethyl)-1-[ethyl(sulfamoyl)amino]cyclopentane

1-(aminomethyl)-1-[ethyl(sulfamoyl)amino]cyclopentane (PubChem CID 114958602) has the molecular formula C8H19N3O2S and a molecular weight of 221.33 g/mol. Its IUPAC name is 1-(aminomethyl)-1-[ethyl(sulfamoyl)amino]cyclopentane.

Molecular Properties

Compound Name1-(aminomethyl)-1-[ethyl(sulfamoyl)amino]cyclopentane
PubChem CID114958602
Molecular FormulaC8H19N3O2S
Molecular Weight221.33 g/mol
Exact Mass221.12
IUPAC Name1-(aminomethyl)-1-[ethyl(sulfamoyl)amino]cyclopentane
SMILESCCN(C1(CN)CCCC1)S(N)(=O)=O
InChIInChI=1S/C8H19N3O2S/c1-2-11(14(10,12)13)8(7-9)5-3-4-6-8/h2-7,9H2,1H3,(H2,10,12,13)
InChIKeyVQZGPKCIYZVITI-UHFFFAOYSA-N
XLogP-0.22
TPSA89.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.33
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-1-[ethyl(sulfamoyl)amino]cyclopentane?
The IUPAC name of 1-(aminomethyl)-1-[ethyl(sulfamoyl)amino]cyclopentane (CID 114958602) is 1-(aminomethyl)-1-[ethyl(sulfamoyl)amino]cyclopentane.
What is the SMILES notation for 1-(aminomethyl)-1-[ethyl(sulfamoyl)amino]cyclopentane?
The canonical SMILES for 1-(aminomethyl)-1-[ethyl(sulfamoyl)amino]cyclopentane is CCN(C1(CN)CCCC1)S(N)(=O)=O.
What is the InChIKey of 1-(aminomethyl)-1-[ethyl(sulfamoyl)amino]cyclopentane?
The InChIKey is VQZGPKCIYZVITI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N3O2S/c1-2-11(14(10,12)13)8(7-9)5-3-4-6-8/h2-7,9H2,1H3,(H2,10,12,13).
What are the key properties of 1-(aminomethyl)-1-[ethyl(sulfamoyl)amino]cyclopentane?
1-(aminomethyl)-1-[ethyl(sulfamoyl)amino]cyclopentane has a molecular weight of 221.33 g/mol, XLogP of -0.22, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-1-[ethyl(sulfamoyl)amino]cyclopentane is sourced from PubChem (CID 114958602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).