ethyl 5-[[4-(methoxymethyl)piperidin-4-yl]methylsulfamoyl]furan-2-carboxylate

C15H24N2O6S — CID 120896379

IUPACethyl 5-[[4-(methoxymethyl)piperidin-4-yl]methylsulfamoyl]furan-2-carboxylate
SMILESCCOC(=O)c1ccc(S(=O)(=O)NCC2(COC)CCNCC2)o1
InChIInChI=1S/C15H24N2O6S/c1-3-22-14(18)12-4-5-13(23-12)24(19,20)17-10-15(11-21-2)6-8-16-9-7-15/h4-5,16-17H,3,6-11H2,1-2H3
InChIKeyAEVMVLBUOFHGEL-UHFFFAOYSA-N
MW360.43 g/mol
LogP0.75
Rot. Bonds8

About ethyl 5-[[4-(methoxymethyl)piperidin-4-yl]methylsulfamoyl]furan-2-carboxylate

ethyl 5-[[4-(methoxymethyl)piperidin-4-yl]methylsulfamoyl]furan-2-carboxylate (PubChem CID 120896379) has the molecular formula C15H24N2O6S and a molecular weight of 360.43 g/mol. Its IUPAC name is ethyl 5-[[4-(methoxymethyl)piperidin-4-yl]methylsulfamoyl]furan-2-carboxylate.

Molecular Properties

Compound Nameethyl 5-[[4-(methoxymethyl)piperidin-4-yl]methylsulfamoyl]furan-2-carboxylate
PubChem CID120896379
Molecular FormulaC15H24N2O6S
Molecular Weight360.43 g/mol
Exact Mass360.14
IUPAC Nameethyl 5-[[4-(methoxymethyl)piperidin-4-yl]methylsulfamoyl]furan-2-carboxylate
SMILESCCOC(=O)c1ccc(S(=O)(=O)NCC2(COC)CCNCC2)o1
InChIInChI=1S/C15H24N2O6S/c1-3-22-14(18)12-4-5-13(23-12)24(19,20)17-10-15(11-21-2)6-8-16-9-7-15/h4-5,16-17H,3,6-11H2,1-2H3
InChIKeyAEVMVLBUOFHGEL-UHFFFAOYSA-N
XLogP0.75
TPSA106.87 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.43
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze ethyl 5-[[4-(methoxymethyl)piperidin-4-yl]methylsulfamoyl]furan-2-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl 5-[[4-(methoxymethyl)piperidin-4-yl]methylsulfamoyl]furan-2-carboxylate;hydrochloride
CID 120896340
5-bromo-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]furan-2-sulfonamide;hydrochloride
CID 120896062
ethyl 3-[[4-(methoxymethyl)piperidin-4-yl]methylsulfamoyl]-4-methylbenzoate
CID 120896425
ethyl 5-(piperidin-4-ylsulfamoyl)furan-2-carboxylate
CID 119960606
ethyl 5-(pyrrolidin-2-ylmethylsulfamoyl)furan-2-carboxylate
CID 119974281
ethyl 5-[2-(2-methoxyethylamino)ethylsulfamoyl]furan-2-carboxylate;hydrochloride
CID 120717695
N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-4-methylsulfonylbenzenesulfonamide
CID 120896801
2-ethyl-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]benzenesulfonamide
CID 120895991
5-chloro-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-methylbenzenesulfonamide;hydrochloride
CID 120896564
4-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-methylbenzenesulfonamide
CID 120896693
N-[[5-[[4-(methoxymethyl)piperidin-4-yl]methylsulfamoyl]thiophen-2-yl]methyl]acetamide;hydrochloride
CID 120896924
ethyl 5-[(3,3,3-trifluoro-2-piperazin-1-ylpropyl)sulfamoyl]furan-2-carboxylate;hydrochloride
CID 120778569

Frequently Asked Questions

What is the IUPAC name of ethyl 5-[[4-(methoxymethyl)piperidin-4-yl]methylsulfamoyl]furan-2-carboxylate?
The IUPAC name of ethyl 5-[[4-(methoxymethyl)piperidin-4-yl]methylsulfamoyl]furan-2-carboxylate (CID 120896379) is ethyl 5-[[4-(methoxymethyl)piperidin-4-yl]methylsulfamoyl]furan-2-carboxylate.
What is the SMILES notation for ethyl 5-[[4-(methoxymethyl)piperidin-4-yl]methylsulfamoyl]furan-2-carboxylate?
The canonical SMILES for ethyl 5-[[4-(methoxymethyl)piperidin-4-yl]methylsulfamoyl]furan-2-carboxylate is CCOC(=O)c1ccc(S(=O)(=O)NCC2(COC)CCNCC2)o1.
What is the InChIKey of ethyl 5-[[4-(methoxymethyl)piperidin-4-yl]methylsulfamoyl]furan-2-carboxylate?
The InChIKey is AEVMVLBUOFHGEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O6S/c1-3-22-14(18)12-4-5-13(23-12)24(19,20)17-10-15(11-21-2)6-8-16-9-7-15/h4-5,16-17H,3,6-11H2,1-2H3.
What are the key properties of ethyl 5-[[4-(methoxymethyl)piperidin-4-yl]methylsulfamoyl]furan-2-carboxylate?
ethyl 5-[[4-(methoxymethyl)piperidin-4-yl]methylsulfamoyl]furan-2-carboxylate has a molecular weight of 360.43 g/mol, XLogP of 0.75, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 5-[[4-(methoxymethyl)piperidin-4-yl]methylsulfamoyl]furan-2-carboxylate is sourced from PubChem (CID 120896379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).