1-(aminomethyl)-N-(ethylsulfamoyl)cyclopentan-1-amine

C8H19N3O2S — CID 115752416

IUPAC1-(aminomethyl)-N-(ethylsulfamoyl)cyclopentan-1-amine
SMILESCCNS(=O)(=O)NC1(CN)CCCC1
InChIInChI=1S/C8H19N3O2S/c1-2-10-14(12,13)11-8(7-9)5-3-4-6-8/h10-11H,2-7,9H2,1H3
InChIKeyPYGWPPUFHRNQJC-UHFFFAOYSA-N
MW221.33 g/mol
LogP-0.30
Rot. Bonds5

About 1-(aminomethyl)-N-(ethylsulfamoyl)cyclopentan-1-amine

1-(aminomethyl)-N-(ethylsulfamoyl)cyclopentan-1-amine (PubChem CID 115752416) has the molecular formula C8H19N3O2S and a molecular weight of 221.33 g/mol. Its IUPAC name is 1-(aminomethyl)-N-(ethylsulfamoyl)cyclopentan-1-amine.

Molecular Properties

Compound Name1-(aminomethyl)-N-(ethylsulfamoyl)cyclopentan-1-amine
PubChem CID115752416
Molecular FormulaC8H19N3O2S
Molecular Weight221.33 g/mol
Exact Mass221.12
IUPAC Name1-(aminomethyl)-N-(ethylsulfamoyl)cyclopentan-1-amine
SMILESCCNS(=O)(=O)NC1(CN)CCCC1
InChIInChI=1S/C8H19N3O2S/c1-2-10-14(12,13)11-8(7-9)5-3-4-6-8/h10-11H,2-7,9H2,1H3
InChIKeyPYGWPPUFHRNQJC-UHFFFAOYSA-N
XLogP-0.30
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.33
LogP ≤ 5-0.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-(ethylsulfamoyl)cyclopentan-1-amine?
The IUPAC name of 1-(aminomethyl)-N-(ethylsulfamoyl)cyclopentan-1-amine (CID 115752416) is 1-(aminomethyl)-N-(ethylsulfamoyl)cyclopentan-1-amine.
What is the SMILES notation for 1-(aminomethyl)-N-(ethylsulfamoyl)cyclopentan-1-amine?
The canonical SMILES for 1-(aminomethyl)-N-(ethylsulfamoyl)cyclopentan-1-amine is CCNS(=O)(=O)NC1(CN)CCCC1.
What is the InChIKey of 1-(aminomethyl)-N-(ethylsulfamoyl)cyclopentan-1-amine?
The InChIKey is PYGWPPUFHRNQJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N3O2S/c1-2-10-14(12,13)11-8(7-9)5-3-4-6-8/h10-11H,2-7,9H2,1H3.
What are the key properties of 1-(aminomethyl)-N-(ethylsulfamoyl)cyclopentan-1-amine?
1-(aminomethyl)-N-(ethylsulfamoyl)cyclopentan-1-amine has a molecular weight of 221.33 g/mol, XLogP of -0.30, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-(ethylsulfamoyl)cyclopentan-1-amine is sourced from PubChem (CID 115752416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).