N-[2-(2-methyl-1,3-dioxolan-2-yl)ethylsulfamoyl]cyclopentanamine

C11H22N2O4S — CID 110611947

IUPACN-[2-(2-methyl-1,3-dioxolan-2-yl)ethylsulfamoyl]cyclopentanamine
SMILESCC1(CCNS(=O)(=O)NC2CCCC2)OCCO1
InChIInChI=1S/C11H22N2O4S/c1-11(16-8-9-17-11)6-7-12-18(14,15)13-10-4-2-3-5-10/h10,12-13H,2-9H2,1H3
InChIKeyWBIXBORYOOWVOX-UHFFFAOYSA-N
MW278.37 g/mol
LogP0.51
Rot. Bonds6

About N-[2-(2-methyl-1,3-dioxolan-2-yl)ethylsulfamoyl]cyclopentanamine

N-[2-(2-methyl-1,3-dioxolan-2-yl)ethylsulfamoyl]cyclopentanamine (PubChem CID 110611947) has the molecular formula C11H22N2O4S and a molecular weight of 278.37 g/mol. Its IUPAC name is N-[2-(2-methyl-1,3-dioxolan-2-yl)ethylsulfamoyl]cyclopentanamine.

Molecular Properties

Compound NameN-[2-(2-methyl-1,3-dioxolan-2-yl)ethylsulfamoyl]cyclopentanamine
PubChem CID110611947
Molecular FormulaC11H22N2O4S
Molecular Weight278.37 g/mol
Exact Mass278.13
IUPAC NameN-[2-(2-methyl-1,3-dioxolan-2-yl)ethylsulfamoyl]cyclopentanamine
SMILESCC1(CCNS(=O)(=O)NC2CCCC2)OCCO1
InChIInChI=1S/C11H22N2O4S/c1-11(16-8-9-17-11)6-7-12-18(14,15)13-10-4-2-3-5-10/h10,12-13H,2-9H2,1H3
InChIKeyWBIXBORYOOWVOX-UHFFFAOYSA-N
XLogP0.51
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.37
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methyl-1,3-dioxolan-2-yl)ethylsulfamoyl]cyclopentanamine?
The IUPAC name of N-[2-(2-methyl-1,3-dioxolan-2-yl)ethylsulfamoyl]cyclopentanamine (CID 110611947) is N-[2-(2-methyl-1,3-dioxolan-2-yl)ethylsulfamoyl]cyclopentanamine.
What is the SMILES notation for N-[2-(2-methyl-1,3-dioxolan-2-yl)ethylsulfamoyl]cyclopentanamine?
The canonical SMILES for N-[2-(2-methyl-1,3-dioxolan-2-yl)ethylsulfamoyl]cyclopentanamine is CC1(CCNS(=O)(=O)NC2CCCC2)OCCO1.
What is the InChIKey of N-[2-(2-methyl-1,3-dioxolan-2-yl)ethylsulfamoyl]cyclopentanamine?
The InChIKey is WBIXBORYOOWVOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O4S/c1-11(16-8-9-17-11)6-7-12-18(14,15)13-10-4-2-3-5-10/h10,12-13H,2-9H2,1H3.
What are the key properties of N-[2-(2-methyl-1,3-dioxolan-2-yl)ethylsulfamoyl]cyclopentanamine?
N-[2-(2-methyl-1,3-dioxolan-2-yl)ethylsulfamoyl]cyclopentanamine has a molecular weight of 278.37 g/mol, XLogP of 0.51, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methyl-1,3-dioxolan-2-yl)ethylsulfamoyl]cyclopentanamine is sourced from PubChem (CID 110611947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).