2-(2-aminoethoxy)-N-[(1-propylcyclopropyl)methyl]ethanesulfonamide

C11H24N2O3S — CID 112751637

IUPAC2-(2-aminoethoxy)-N-[(1-propylcyclopropyl)methyl]ethanesulfonamide
SMILESCCCC1(CNS(=O)(=O)CCOCCN)CC1
InChIInChI=1S/C11H24N2O3S/c1-2-3-11(4-5-11)10-13-17(14,15)9-8-16-7-6-12/h13H,2-10,12H2,1H3
InChIKeyMUFBONVOCLIPJM-UHFFFAOYSA-N
MW264.39 g/mol
LogP0.46
Rot. Bonds10

About 2-(2-aminoethoxy)-N-[(1-propylcyclopropyl)methyl]ethanesulfonamide

2-(2-aminoethoxy)-N-[(1-propylcyclopropyl)methyl]ethanesulfonamide (PubChem CID 112751637) has the molecular formula C11H24N2O3S and a molecular weight of 264.39 g/mol. Its IUPAC name is 2-(2-aminoethoxy)-N-[(1-propylcyclopropyl)methyl]ethanesulfonamide.

Molecular Properties

Compound Name2-(2-aminoethoxy)-N-[(1-propylcyclopropyl)methyl]ethanesulfonamide
PubChem CID112751637
Molecular FormulaC11H24N2O3S
Molecular Weight264.39 g/mol
Exact Mass264.15
IUPAC Name2-(2-aminoethoxy)-N-[(1-propylcyclopropyl)methyl]ethanesulfonamide
SMILESCCCC1(CNS(=O)(=O)CCOCCN)CC1
InChIInChI=1S/C11H24N2O3S/c1-2-3-11(4-5-11)10-13-17(14,15)9-8-16-7-6-12/h13H,2-10,12H2,1H3
InChIKeyMUFBONVOCLIPJM-UHFFFAOYSA-N
XLogP0.46
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2-aminoethoxy)-N-[(1-methylsulfanylcyclobutyl)methyl]ethanesulfonamide
CID 112751639
4-chloro-N-[(1-propylcyclopropyl)methyl]butane-1-sulfonamide
CID 105055894
N-[[1-(bromomethyl)cyclopropyl]methyl]propane-1-sulfonamide
CID 115456556
N-[[1-(aminomethyl)cyclopropyl]methyl]-3-methoxypropane-1-sulfonamide
CID 115456941
N-[[1-(chloromethyl)cyclohexyl]methyl]-2-ethoxyethanesulfonamide
CID 103970051
2-(2-ethylsulfonylethoxy)ethanamine
CID 62343611
2-ethoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]ethanesulfonamide
CID 120896019
N-[(1-propylcyclopropyl)methyl]propane-2-sulfonamide
CID 103761867
N-[[1-(methylaminomethyl)cyclopropyl]methyl]butane-1-sulfonamide
CID 115267418
4-amino-N-[(1-ethylcyclopentyl)methyl]butane-1-sulfonamide
CID 114124982
1-(2-aminoethyl)-1-[(sulfamoylamino)methyl]cyclopropane
CID 114959649
N-[[1-(chloromethyl)cyclopropyl]methyl]-2-propan-2-yloxyethanesulfonamide
CID 115456635

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethoxy)-N-[(1-propylcyclopropyl)methyl]ethanesulfonamide?
The IUPAC name of 2-(2-aminoethoxy)-N-[(1-propylcyclopropyl)methyl]ethanesulfonamide (CID 112751637) is 2-(2-aminoethoxy)-N-[(1-propylcyclopropyl)methyl]ethanesulfonamide.
What is the SMILES notation for 2-(2-aminoethoxy)-N-[(1-propylcyclopropyl)methyl]ethanesulfonamide?
The canonical SMILES for 2-(2-aminoethoxy)-N-[(1-propylcyclopropyl)methyl]ethanesulfonamide is CCCC1(CNS(=O)(=O)CCOCCN)CC1.
What is the InChIKey of 2-(2-aminoethoxy)-N-[(1-propylcyclopropyl)methyl]ethanesulfonamide?
The InChIKey is MUFBONVOCLIPJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3S/c1-2-3-11(4-5-11)10-13-17(14,15)9-8-16-7-6-12/h13H,2-10,12H2,1H3.
What are the key properties of 2-(2-aminoethoxy)-N-[(1-propylcyclopropyl)methyl]ethanesulfonamide?
2-(2-aminoethoxy)-N-[(1-propylcyclopropyl)methyl]ethanesulfonamide has a molecular weight of 264.39 g/mol, XLogP of 0.46, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethoxy)-N-[(1-propylcyclopropyl)methyl]ethanesulfonamide is sourced from PubChem (CID 112751637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).