1-(aminomethyl)-N-(tert-butylsulfamoyl)cyclopentan-1-amine

C10H23N3O2S — CID 114803345

IUPAC1-(aminomethyl)-N-(tert-butylsulfamoyl)cyclopentan-1-amine
SMILESCC(C)(C)NS(=O)(=O)NC1(CN)CCCC1
InChIInChI=1S/C10H23N3O2S/c1-9(2,3)12-16(14,15)13-10(8-11)6-4-5-7-10/h12-13H,4-8,11H2,1-3H3
InChIKeyLWAFGRNPFQVZFB-UHFFFAOYSA-N
MW249.38 g/mol
LogP0.48
Rot. Bonds4

About 1-(aminomethyl)-N-(tert-butylsulfamoyl)cyclopentan-1-amine

1-(aminomethyl)-N-(tert-butylsulfamoyl)cyclopentan-1-amine (PubChem CID 114803345) has the molecular formula C10H23N3O2S and a molecular weight of 249.38 g/mol. Its IUPAC name is 1-(aminomethyl)-N-(tert-butylsulfamoyl)cyclopentan-1-amine.

Molecular Properties

Compound Name1-(aminomethyl)-N-(tert-butylsulfamoyl)cyclopentan-1-amine
PubChem CID114803345
Molecular FormulaC10H23N3O2S
Molecular Weight249.38 g/mol
Exact Mass249.15
IUPAC Name1-(aminomethyl)-N-(tert-butylsulfamoyl)cyclopentan-1-amine
SMILESCC(C)(C)NS(=O)(=O)NC1(CN)CCCC1
InChIInChI=1S/C10H23N3O2S/c1-9(2,3)12-16(14,15)13-10(8-11)6-4-5-7-10/h12-13H,4-8,11H2,1-3H3
InChIKeyLWAFGRNPFQVZFB-UHFFFAOYSA-N
XLogP0.48
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.38
LogP ≤ 50.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-(tert-butylsulfamoyl)cyclopentan-1-amine?
The IUPAC name of 1-(aminomethyl)-N-(tert-butylsulfamoyl)cyclopentan-1-amine (CID 114803345) is 1-(aminomethyl)-N-(tert-butylsulfamoyl)cyclopentan-1-amine.
What is the SMILES notation for 1-(aminomethyl)-N-(tert-butylsulfamoyl)cyclopentan-1-amine?
The canonical SMILES for 1-(aminomethyl)-N-(tert-butylsulfamoyl)cyclopentan-1-amine is CC(C)(C)NS(=O)(=O)NC1(CN)CCCC1.
What is the InChIKey of 1-(aminomethyl)-N-(tert-butylsulfamoyl)cyclopentan-1-amine?
The InChIKey is LWAFGRNPFQVZFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O2S/c1-9(2,3)12-16(14,15)13-10(8-11)6-4-5-7-10/h12-13H,4-8,11H2,1-3H3.
What are the key properties of 1-(aminomethyl)-N-(tert-butylsulfamoyl)cyclopentan-1-amine?
1-(aminomethyl)-N-(tert-butylsulfamoyl)cyclopentan-1-amine has a molecular weight of 249.38 g/mol, XLogP of 0.48, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-(tert-butylsulfamoyl)cyclopentan-1-amine is sourced from PubChem (CID 114803345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).