3-amino-N-cyclopentyl-N-methylpropane-1-sulfonamide

C9H20N2O2S — CID 60910343

IUPAC3-amino-N-cyclopentyl-N-methylpropane-1-sulfonamide
SMILESCN(C1CCCC1)S(=O)(=O)CCCN
InChIInChI=1S/C9H20N2O2S/c1-11(9-5-2-3-6-9)14(12,13)8-4-7-10/h9H,2-8,10H2,1H3
InChIKeyYLAPZOJIWJNKRF-UHFFFAOYSA-N
MW220.34 g/mol
LogP0.54
Rot. Bonds5

About 3-amino-N-cyclopentyl-N-methylpropane-1-sulfonamide

3-amino-N-cyclopentyl-N-methylpropane-1-sulfonamide (PubChem CID 60910343) has the molecular formula C9H20N2O2S and a molecular weight of 220.34 g/mol. Its IUPAC name is 3-amino-N-cyclopentyl-N-methylpropane-1-sulfonamide.

Molecular Properties

Compound Name3-amino-N-cyclopentyl-N-methylpropane-1-sulfonamide
PubChem CID60910343
Molecular FormulaC9H20N2O2S
Molecular Weight220.34 g/mol
Exact Mass220.12
IUPAC Name3-amino-N-cyclopentyl-N-methylpropane-1-sulfonamide
SMILESCN(C1CCCC1)S(=O)(=O)CCCN
InChIInChI=1S/C9H20N2O2S/c1-11(9-5-2-3-6-9)14(12,13)8-4-7-10/h9H,2-8,10H2,1H3
InChIKeyYLAPZOJIWJNKRF-UHFFFAOYSA-N
XLogP0.54
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.34
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-cyclopentyl-N-methylpropane-1-sulfonamide?
The IUPAC name of 3-amino-N-cyclopentyl-N-methylpropane-1-sulfonamide (CID 60910343) is 3-amino-N-cyclopentyl-N-methylpropane-1-sulfonamide.
What is the SMILES notation for 3-amino-N-cyclopentyl-N-methylpropane-1-sulfonamide?
The canonical SMILES for 3-amino-N-cyclopentyl-N-methylpropane-1-sulfonamide is CN(C1CCCC1)S(=O)(=O)CCCN.
What is the InChIKey of 3-amino-N-cyclopentyl-N-methylpropane-1-sulfonamide?
The InChIKey is YLAPZOJIWJNKRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2S/c1-11(9-5-2-3-6-9)14(12,13)8-4-7-10/h9H,2-8,10H2,1H3.
What are the key properties of 3-amino-N-cyclopentyl-N-methylpropane-1-sulfonamide?
3-amino-N-cyclopentyl-N-methylpropane-1-sulfonamide has a molecular weight of 220.34 g/mol, XLogP of 0.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-cyclopentyl-N-methylpropane-1-sulfonamide is sourced from PubChem (CID 60910343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).