N-(furan-2-ylmethyl)-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]acetamide

C17H22N2O4S — CID 984199

IUPACN-(furan-2-ylmethyl)-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]acetamide
SMILESCc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NCc2ccco2)c1C
InChIInChI=1S/C17H22N2O4S/c1-11-8-12(2)14(4)17(13(11)3)24(21,22)19-10-16(20)18-9-15-6-5-7-23-15/h5-8,19H,9-10H2,1-4H3,(H,18,20)
InChIKeyBOOZUPJLUBEQSW-UHFFFAOYSA-N
MW350.44 g/mol
LogP2.11
Rot. Bonds6

About N-(furan-2-ylmethyl)-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]acetamide

N-(furan-2-ylmethyl)-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]acetamide (PubChem CID 984199) has the molecular formula C17H22N2O4S and a molecular weight of 350.44 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]acetamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]acetamide
PubChem CID984199
Molecular FormulaC17H22N2O4S
Molecular Weight350.44 g/mol
Exact Mass350.13
IUPAC NameN-(furan-2-ylmethyl)-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]acetamide
SMILESCc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NCc2ccco2)c1C
InChIInChI=1S/C17H22N2O4S/c1-11-8-12(2)14(4)17(13(11)3)24(21,22)19-10-16(20)18-9-15-6-5-7-23-15/h5-8,19H,9-10H2,1-4H3,(H,18,20)
InChIKeyBOOZUPJLUBEQSW-UHFFFAOYSA-N
XLogP2.11
TPSA88.41 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.44
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(furan-2-ylmethyl)-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]acetamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]acetamide (CID 984199) is N-(furan-2-ylmethyl)-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]acetamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]acetamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]acetamide is Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NCc2ccco2)c1C.
What is the InChIKey of N-(furan-2-ylmethyl)-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]acetamide?
The InChIKey is BOOZUPJLUBEQSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O4S/c1-11-8-12(2)14(4)17(13(11)3)24(21,22)19-10-16(20)18-9-15-6-5-7-23-15/h5-8,19H,9-10H2,1-4H3,(H,18,20).
What are the key properties of N-(furan-2-ylmethyl)-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]acetamide?
N-(furan-2-ylmethyl)-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]acetamide has a molecular weight of 350.44 g/mol, XLogP of 2.11, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]acetamide is sourced from PubChem (CID 984199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).