N-[[1-(aminomethyl)cyclopropyl]methyl]cyclopentanesulfonamide

C10H20N2O2S — CID 105361881

IUPACN-[[1-(aminomethyl)cyclopropyl]methyl]cyclopentanesulfonamide
SMILESNCC1(CNS(=O)(=O)C2CCCC2)CC1
InChIInChI=1S/C10H20N2O2S/c11-7-10(5-6-10)8-12-15(13,14)9-3-1-2-4-9/h9,12H,1-8,11H2
InChIKeyXAMWIWFBJFVCGK-UHFFFAOYSA-N
MW232.35 g/mol
LogP0.59
Rot. Bonds5

About N-[[1-(aminomethyl)cyclopropyl]methyl]cyclopentanesulfonamide

N-[[1-(aminomethyl)cyclopropyl]methyl]cyclopentanesulfonamide (PubChem CID 105361881) has the molecular formula C10H20N2O2S and a molecular weight of 232.35 g/mol. Its IUPAC name is N-[[1-(aminomethyl)cyclopropyl]methyl]cyclopentanesulfonamide.

Molecular Properties

Compound NameN-[[1-(aminomethyl)cyclopropyl]methyl]cyclopentanesulfonamide
PubChem CID105361881
Molecular FormulaC10H20N2O2S
Molecular Weight232.35 g/mol
Exact Mass232.12
IUPAC NameN-[[1-(aminomethyl)cyclopropyl]methyl]cyclopentanesulfonamide
SMILESNCC1(CNS(=O)(=O)C2CCCC2)CC1
InChIInChI=1S/C10H20N2O2S/c11-7-10(5-6-10)8-12-15(13,14)9-3-1-2-4-9/h9,12H,1-8,11H2
InChIKeyXAMWIWFBJFVCGK-UHFFFAOYSA-N
XLogP0.59
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(aminomethyl)cyclopropyl]methyl]cyclopentanesulfonamide?
The IUPAC name of N-[[1-(aminomethyl)cyclopropyl]methyl]cyclopentanesulfonamide (CID 105361881) is N-[[1-(aminomethyl)cyclopropyl]methyl]cyclopentanesulfonamide.
What is the SMILES notation for N-[[1-(aminomethyl)cyclopropyl]methyl]cyclopentanesulfonamide?
The canonical SMILES for N-[[1-(aminomethyl)cyclopropyl]methyl]cyclopentanesulfonamide is NCC1(CNS(=O)(=O)C2CCCC2)CC1.
What is the InChIKey of N-[[1-(aminomethyl)cyclopropyl]methyl]cyclopentanesulfonamide?
The InChIKey is XAMWIWFBJFVCGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2S/c11-7-10(5-6-10)8-12-15(13,14)9-3-1-2-4-9/h9,12H,1-8,11H2.
What are the key properties of N-[[1-(aminomethyl)cyclopropyl]methyl]cyclopentanesulfonamide?
N-[[1-(aminomethyl)cyclopropyl]methyl]cyclopentanesulfonamide has a molecular weight of 232.35 g/mol, XLogP of 0.59, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(aminomethyl)cyclopropyl]methyl]cyclopentanesulfonamide is sourced from PubChem (CID 105361881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).