5-(aminomethyl)-N-(3-ethoxycyclobutyl)furan-2-sulfonamide

C11H18N2O4S — CID 114120981

IUPAC5-(aminomethyl)-N-(3-ethoxycyclobutyl)furan-2-sulfonamide
SMILESCCOC1CC(NS(=O)(=O)c2ccc(CN)o2)C1
InChIInChI=1S/C11H18N2O4S/c1-2-16-10-5-8(6-10)13-18(14,15)11-4-3-9(7-12)17-11/h3-4,8,10,13H,2,5-7,12H2,1H3
InChIKeyYRETZZREJJCICZ-UHFFFAOYSA-N
MW274.34 g/mol
LogP0.58
Rot. Bonds6

About 5-(aminomethyl)-N-(3-ethoxycyclobutyl)furan-2-sulfonamide

5-(aminomethyl)-N-(3-ethoxycyclobutyl)furan-2-sulfonamide (PubChem CID 114120981) has the molecular formula C11H18N2O4S and a molecular weight of 274.34 g/mol. Its IUPAC name is 5-(aminomethyl)-N-(3-ethoxycyclobutyl)furan-2-sulfonamide.

Molecular Properties

Compound Name5-(aminomethyl)-N-(3-ethoxycyclobutyl)furan-2-sulfonamide
PubChem CID114120981
Molecular FormulaC11H18N2O4S
Molecular Weight274.34 g/mol
Exact Mass274.10
IUPAC Name5-(aminomethyl)-N-(3-ethoxycyclobutyl)furan-2-sulfonamide
SMILESCCOC1CC(NS(=O)(=O)c2ccc(CN)o2)C1
InChIInChI=1S/C11H18N2O4S/c1-2-16-10-5-8(6-10)13-18(14,15)11-4-3-9(7-12)17-11/h3-4,8,10,13H,2,5-7,12H2,1H3
InChIKeyYRETZZREJJCICZ-UHFFFAOYSA-N
XLogP0.58
TPSA94.56 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-[(3-ethoxycyclobutyl)sulfamoyl]furan-2-carboxylic acid
CID 114118892
5-(aminomethyl)-N-(2,2-diethyloxan-4-yl)furan-2-sulfonamide
CID 83036290
4-bromo-N-(3-ethoxycyclobutyl)benzenesulfonamide
CID 102609509
N-(3-ethoxycyclobutyl)-2-hydroxybenzenesulfonamide
CID 114120079
3-N-(3-ethoxycyclobutyl)benzene-1,3-disulfonamide
CID 102609465
2-amino-N-(3-ethoxycyclobutyl)pyrimidine-5-sulfonamide
CID 114120750
N-(3-ethoxycyclobutyl)-3-fluoropyridine-2-sulfonamide
CID 114118992
N-(3-ethoxycyclobutyl)propane-2-sulfonamide
CID 102609488
N-(3-ethoxycyclobutyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 102609491
5-bromo-N-(3-ethoxycyclobutyl)-2-nitrobenzenesulfonamide
CID 102609499
5-(aminomethyl)-N-[(1-methylpyrrolidin-2-yl)methyl]furan-2-sulfonamide
CID 106028482
5-(aminomethyl)-N-[2-(1-methylpiperidin-4-yl)ethyl]furan-2-sulfonamide
CID 114516893

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-(3-ethoxycyclobutyl)furan-2-sulfonamide?
The IUPAC name of 5-(aminomethyl)-N-(3-ethoxycyclobutyl)furan-2-sulfonamide (CID 114120981) is 5-(aminomethyl)-N-(3-ethoxycyclobutyl)furan-2-sulfonamide.
What is the SMILES notation for 5-(aminomethyl)-N-(3-ethoxycyclobutyl)furan-2-sulfonamide?
The canonical SMILES for 5-(aminomethyl)-N-(3-ethoxycyclobutyl)furan-2-sulfonamide is CCOC1CC(NS(=O)(=O)c2ccc(CN)o2)C1.
What is the InChIKey of 5-(aminomethyl)-N-(3-ethoxycyclobutyl)furan-2-sulfonamide?
The InChIKey is YRETZZREJJCICZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O4S/c1-2-16-10-5-8(6-10)13-18(14,15)11-4-3-9(7-12)17-11/h3-4,8,10,13H,2,5-7,12H2,1H3.
What are the key properties of 5-(aminomethyl)-N-(3-ethoxycyclobutyl)furan-2-sulfonamide?
5-(aminomethyl)-N-(3-ethoxycyclobutyl)furan-2-sulfonamide has a molecular weight of 274.34 g/mol, XLogP of 0.58, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-(3-ethoxycyclobutyl)furan-2-sulfonamide is sourced from PubChem (CID 114120981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).