N-[(2R)-2-(1-benzofuran-2-yl)-2-methoxyethyl]ethanesulfonamide

C13H17NO4S — CID 124891766

IUPACN-[(2R)-2-(1-benzofuran-2-yl)-2-methoxyethyl]ethanesulfonamide
SMILESCCS(=O)(=O)NC[C@@H](OC)c1cc2ccccc2o1
InChIInChI=1S/C13H17NO4S/c1-3-19(15,16)14-9-13(17-2)12-8-10-6-4-5-7-11(10)18-12/h4-8,13-14H,3,9H2,1-2H3/t13-/m1/s1
InChIKeyGKKQAJNEKDNOIS-CYBMUJFWSA-N
MW283.35 g/mol
LogP2.06
Rot. Bonds6

About N-[(2R)-2-(1-benzofuran-2-yl)-2-methoxyethyl]ethanesulfonamide

N-[(2R)-2-(1-benzofuran-2-yl)-2-methoxyethyl]ethanesulfonamide (PubChem CID 124891766) has the molecular formula C13H17NO4S and a molecular weight of 283.35 g/mol. Its IUPAC name is N-[(2R)-2-(1-benzofuran-2-yl)-2-methoxyethyl]ethanesulfonamide.

Molecular Properties

Compound NameN-[(2R)-2-(1-benzofuran-2-yl)-2-methoxyethyl]ethanesulfonamide
PubChem CID124891766
Molecular FormulaC13H17NO4S
Molecular Weight283.35 g/mol
Exact Mass283.09
IUPAC NameN-[(2R)-2-(1-benzofuran-2-yl)-2-methoxyethyl]ethanesulfonamide
SMILESCCS(=O)(=O)NC[C@@H](OC)c1cc2ccccc2o1
InChIInChI=1S/C13H17NO4S/c1-3-19(15,16)14-9-13(17-2)12-8-10-6-4-5-7-11(10)18-12/h4-8,13-14H,3,9H2,1-2H3/t13-/m1/s1
InChIKeyGKKQAJNEKDNOIS-CYBMUJFWSA-N
XLogP2.06
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.35
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(2R)-2-(1-benzofuran-2-yl)-2-methoxyethyl]ethanesulfonamide 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

(2R)-2-(1-benzofuran-2-yl)-2-methoxyethanamine
CID 94846259
N-[(2S)-2-(1-benzofuran-2-yl)-2-methoxyethyl]cyclopropanecarboxamide
CID 129356177
(2R)-N-[(2R)-2-(1-benzofuran-2-yl)-2-methoxyethyl]-2-phenylbutanamide
CID 124891805
N-[2-(1-benzofuran-2-yl)-2-methoxyethyl]-3-(4-methylsulfonylphenyl)propanamide
CID 121021281
N-[2-(1-benzofuran-2-yl)-2-methoxyethyl]-1,3-benzothiazole-2-carboxamide
CID 119104098
N-[2-(1-benzofuran-2-yl)-2-methoxyethyl]-2-(4-chlorophenoxy)-2-methylpropanamide
CID 121021275
N'-[2-(1-benzofuran-2-yl)-2-methoxyethyl]-N-[(4-fluorophenyl)methyl]oxamide
CID 119104126
N-[(2R)-2-(1-benzofuran-2-yl)-2-methoxyethyl]-5-chlorothiophene-2-carboxamide
CID 124892530
N-[(2R)-2-(1-benzofuran-2-yl)-2-methoxyethyl]-1,3-benzodioxole-5-carboxamide
CID 124727869
N-[(2R)-2-(1-benzofuran-2-yl)-2-methoxyethyl]-2-chloro-6-fluorobenzamide
CID 124761461
1-[(2R)-2-(1-benzofuran-2-yl)-2-methoxyethyl]-3-[(3,4-dimethoxyphenyl)methyl]urea
CID 124892212
1-(1-adamantyl)-3-[(2S)-2-(1-benzofuran-2-yl)-2-methoxyethyl]urea
CID 124727341

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(1-benzofuran-2-yl)-2-methoxyethyl]ethanesulfonamide?
The IUPAC name of N-[(2R)-2-(1-benzofuran-2-yl)-2-methoxyethyl]ethanesulfonamide (CID 124891766) is N-[(2R)-2-(1-benzofuran-2-yl)-2-methoxyethyl]ethanesulfonamide.
What is the SMILES notation for N-[(2R)-2-(1-benzofuran-2-yl)-2-methoxyethyl]ethanesulfonamide?
The canonical SMILES for N-[(2R)-2-(1-benzofuran-2-yl)-2-methoxyethyl]ethanesulfonamide is CCS(=O)(=O)NC[C@@H](OC)c1cc2ccccc2o1.
What is the InChIKey of N-[(2R)-2-(1-benzofuran-2-yl)-2-methoxyethyl]ethanesulfonamide?
The InChIKey is GKKQAJNEKDNOIS-CYBMUJFWSA-N. The full InChI is InChI=1S/C13H17NO4S/c1-3-19(15,16)14-9-13(17-2)12-8-10-6-4-5-7-11(10)18-12/h4-8,13-14H,3,9H2,1-2H3/t13-/m1/s1.
What are the key properties of N-[(2R)-2-(1-benzofuran-2-yl)-2-methoxyethyl]ethanesulfonamide?
N-[(2R)-2-(1-benzofuran-2-yl)-2-methoxyethyl]ethanesulfonamide has a molecular weight of 283.35 g/mol, XLogP of 2.06, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(1-benzofuran-2-yl)-2-methoxyethyl]ethanesulfonamide is sourced from PubChem (CID 124891766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).