2-[ethyl-(4-methoxyphenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide

C16H20N2O5S — CID 6493385

IUPAC2-[ethyl-(4-methoxyphenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide
SMILESCCN(CC(=O)NCc1ccco1)S(=O)(=O)c1ccc(OC)cc1
InChIInChI=1S/C16H20N2O5S/c1-3-18(12-16(19)17-11-14-5-4-10-23-14)24(20,21)15-8-6-13(22-2)7-9-15/h4-10H,3,11-12H2,1-2H3,(H,17,19)
InChIKeyHZCOAKQZAJRAJU-UHFFFAOYSA-N
MW352.41 g/mol
LogP1.62
Rot. Bonds8

About 2-[ethyl-(4-methoxyphenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide

2-[ethyl-(4-methoxyphenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide (PubChem CID 6493385) has the molecular formula C16H20N2O5S and a molecular weight of 352.41 g/mol. Its IUPAC name is 2-[ethyl-(4-methoxyphenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-[ethyl-(4-methoxyphenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide
PubChem CID6493385
Molecular FormulaC16H20N2O5S
Molecular Weight352.41 g/mol
Exact Mass352.11
IUPAC Name2-[ethyl-(4-methoxyphenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide
SMILESCCN(CC(=O)NCc1ccco1)S(=O)(=O)c1ccc(OC)cc1
InChIInChI=1S/C16H20N2O5S/c1-3-18(12-16(19)17-11-14-5-4-10-23-14)24(20,21)15-8-6-13(22-2)7-9-15/h4-10H,3,11-12H2,1-2H3,(H,17,19)
InChIKeyHZCOAKQZAJRAJU-UHFFFAOYSA-N
XLogP1.62
TPSA88.85 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.41
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-(4-methoxyphenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide?
The IUPAC name of 2-[ethyl-(4-methoxyphenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide (CID 6493385) is 2-[ethyl-(4-methoxyphenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide.
What is the SMILES notation for 2-[ethyl-(4-methoxyphenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide?
The canonical SMILES for 2-[ethyl-(4-methoxyphenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide is CCN(CC(=O)NCc1ccco1)S(=O)(=O)c1ccc(OC)cc1.
What is the InChIKey of 2-[ethyl-(4-methoxyphenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide?
The InChIKey is HZCOAKQZAJRAJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O5S/c1-3-18(12-16(19)17-11-14-5-4-10-23-14)24(20,21)15-8-6-13(22-2)7-9-15/h4-10H,3,11-12H2,1-2H3,(H,17,19).
What are the key properties of 2-[ethyl-(4-methoxyphenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide?
2-[ethyl-(4-methoxyphenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide has a molecular weight of 352.41 g/mol, XLogP of 1.62, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-(4-methoxyphenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide is sourced from PubChem (CID 6493385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).