1-(aminomethyl)-N-(dimethylsulfamoyl)-N-methylcyclopentan-1-amine

C9H21N3O2S — CID 62009826

IUPAC1-(aminomethyl)-N-(dimethylsulfamoyl)-N-methylcyclopentan-1-amine
SMILESCN(C)S(=O)(=O)N(C)C1(CN)CCCC1
InChIInChI=1S/C9H21N3O2S/c1-11(2)15(13,14)12(3)9(8-10)6-4-5-7-9/h4-8,10H2,1-3H3
InChIKeyWWHFJJFWJGHISZ-UHFFFAOYSA-N
MW235.35 g/mol
LogP-0.00
Rot. Bonds4

About 1-(aminomethyl)-N-(dimethylsulfamoyl)-N-methylcyclopentan-1-amine

1-(aminomethyl)-N-(dimethylsulfamoyl)-N-methylcyclopentan-1-amine (PubChem CID 62009826) has the molecular formula C9H21N3O2S and a molecular weight of 235.35 g/mol. Its IUPAC name is 1-(aminomethyl)-N-(dimethylsulfamoyl)-N-methylcyclopentan-1-amine.

Molecular Properties

Compound Name1-(aminomethyl)-N-(dimethylsulfamoyl)-N-methylcyclopentan-1-amine
PubChem CID62009826
Molecular FormulaC9H21N3O2S
Molecular Weight235.35 g/mol
Exact Mass235.14
IUPAC Name1-(aminomethyl)-N-(dimethylsulfamoyl)-N-methylcyclopentan-1-amine
SMILESCN(C)S(=O)(=O)N(C)C1(CN)CCCC1
InChIInChI=1S/C9H21N3O2S/c1-11(2)15(13,14)12(3)9(8-10)6-4-5-7-9/h4-8,10H2,1-3H3
InChIKeyWWHFJJFWJGHISZ-UHFFFAOYSA-N
XLogP-0.00
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.35
LogP ≤ 5-0.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-(dimethylsulfamoyl)-N-methylcyclopentan-1-amine?
The IUPAC name of 1-(aminomethyl)-N-(dimethylsulfamoyl)-N-methylcyclopentan-1-amine (CID 62009826) is 1-(aminomethyl)-N-(dimethylsulfamoyl)-N-methylcyclopentan-1-amine.
What is the SMILES notation for 1-(aminomethyl)-N-(dimethylsulfamoyl)-N-methylcyclopentan-1-amine?
The canonical SMILES for 1-(aminomethyl)-N-(dimethylsulfamoyl)-N-methylcyclopentan-1-amine is CN(C)S(=O)(=O)N(C)C1(CN)CCCC1.
What is the InChIKey of 1-(aminomethyl)-N-(dimethylsulfamoyl)-N-methylcyclopentan-1-amine?
The InChIKey is WWHFJJFWJGHISZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3O2S/c1-11(2)15(13,14)12(3)9(8-10)6-4-5-7-9/h4-8,10H2,1-3H3.
What are the key properties of 1-(aminomethyl)-N-(dimethylsulfamoyl)-N-methylcyclopentan-1-amine?
1-(aminomethyl)-N-(dimethylsulfamoyl)-N-methylcyclopentan-1-amine has a molecular weight of 235.35 g/mol, XLogP of -0.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-(dimethylsulfamoyl)-N-methylcyclopentan-1-amine is sourced from PubChem (CID 62009826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).