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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Related Compounds

N-[2-(4-sulfamoylphenyl)ethyl]furan-2-carboxamide
CID 2905675
(4-Benzenesulfonyl-piperazin-1-yl)-furan-2-yl-methanone
CID 719657
N1-(2-cyanoethyl)-N1-(2-furylmethyl)-3,4-dimethoxybenzene-1-sulfonamide
CID 2800759
N~2~-(3-aminopropyl)-N-[(furan-2-yl)methyl]-N~2~-(2-phenylethyl)-N-[2-(4-sulfamoylphenyl)ethyl]glycinamide
CID 146171280
2-(4-Fluoro-benzenesulfonylamino)-N-furan-2-ylmethyl-N-(phenethylcarbamoyl-methyl)-acetamide
CID 653223
4-Dipropylsulfamoyl-N-furan-2-ylmethyl-benzamide
CID 1128083
3-[[(3,4-dimethoxyphenyl)sulfonyl](2-furylmethyl)amino]-N-methylpropanamide
CID 2822846
3-(benzenesulfonamido)-N-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 4807529
N-Furan-2-ylmethyl-4-(4-methyl-piperidine-1-sulfonyl)-benzamide
CID 1044182
N-Furan-2-ylmethyl-4-[(tetrahydro-furan-2-ylmethyl)-sulfamoyl]-benzamide
CID 645494
N-(2-furylmethyl)-4-({[(4-methylphenyl)sulfonyl]amino}methyl)cyclohexanecarboxamide
CID 3239602
4-chloro-N-[(5-methylfuran-2-yl)methyl]-N-[(3R)-2-oxoazepan-3-yl]benzenesulfonamide
CID 54586573

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).