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

C9H19N3O2S — CID 114803346

IUPAC1-(aminomethyl)-N-(cyclopropylsulfamoyl)cyclopentan-1-amine
SMILESNCC1(NS(=O)(=O)NC2CC2)CCCC1
InChIInChI=1S/C9H19N3O2S/c10-7-9(5-1-2-6-9)12-15(13,14)11-8-3-4-8/h8,11-12H,1-7,10H2
InChIKeyDZVDBBHVRPLNJA-UHFFFAOYSA-N
MW233.34 g/mol
LogP-0.16
Rot. Bonds5

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

1-(aminomethyl)-N-(cyclopropylsulfamoyl)cyclopentan-1-amine (PubChem CID 114803346) has the molecular formula C9H19N3O2S and a molecular weight of 233.34 g/mol. Its IUPAC name is 1-(aminomethyl)-N-(cyclopropylsulfamoyl)cyclopentan-1-amine.

Molecular Properties

Compound Name1-(aminomethyl)-N-(cyclopropylsulfamoyl)cyclopentan-1-amine
PubChem CID114803346
Molecular FormulaC9H19N3O2S
Molecular Weight233.34 g/mol
Exact Mass233.12
IUPAC Name1-(aminomethyl)-N-(cyclopropylsulfamoyl)cyclopentan-1-amine
SMILESNCC1(NS(=O)(=O)NC2CC2)CCCC1
InChIInChI=1S/C9H19N3O2S/c10-7-9(5-1-2-6-9)12-15(13,14)11-8-3-4-8/h8,11-12H,1-7,10H2
InChIKeyDZVDBBHVRPLNJA-UHFFFAOYSA-N
XLogP-0.16
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.34
LogP ≤ 5-0.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-(cyclopropylsulfamoyl)cyclopentan-1-amine?
The IUPAC name of 1-(aminomethyl)-N-(cyclopropylsulfamoyl)cyclopentan-1-amine (CID 114803346) is 1-(aminomethyl)-N-(cyclopropylsulfamoyl)cyclopentan-1-amine.
What is the SMILES notation for 1-(aminomethyl)-N-(cyclopropylsulfamoyl)cyclopentan-1-amine?
The canonical SMILES for 1-(aminomethyl)-N-(cyclopropylsulfamoyl)cyclopentan-1-amine is NCC1(NS(=O)(=O)NC2CC2)CCCC1.
What is the InChIKey of 1-(aminomethyl)-N-(cyclopropylsulfamoyl)cyclopentan-1-amine?
The InChIKey is DZVDBBHVRPLNJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O2S/c10-7-9(5-1-2-6-9)12-15(13,14)11-8-3-4-8/h8,11-12H,1-7,10H2.
What are the key properties of 1-(aminomethyl)-N-(cyclopropylsulfamoyl)cyclopentan-1-amine?
1-(aminomethyl)-N-(cyclopropylsulfamoyl)cyclopentan-1-amine has a molecular weight of 233.34 g/mol, XLogP of -0.16, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-(cyclopropylsulfamoyl)cyclopentan-1-amine is sourced from PubChem (CID 114803346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).