2-[5-[ethyl(2-methoxyethyl)sulfamoyl]thiophen-2-yl]acetic acid

C11H17NO5S2 — CID 61384509

IUPAC2-[5-[ethyl(2-methoxyethyl)sulfamoyl]thiophen-2-yl]acetic acid
SMILESCCN(CCOC)S(=O)(=O)c1ccc(CC(=O)O)s1
InChIInChI=1S/C11H17NO5S2/c1-3-12(6-7-17-2)19(15,16)11-5-4-9(18-11)8-10(13)14/h4-5H,3,6-8H2,1-2H3,(H,13,14)
InChIKeyYPCSAZURFHXJKZ-UHFFFAOYSA-N
MW307.39 g/mol
LogP1.03
Rot. Bonds8

About 2-[5-[ethyl(2-methoxyethyl)sulfamoyl]thiophen-2-yl]acetic acid

2-[5-[ethyl(2-methoxyethyl)sulfamoyl]thiophen-2-yl]acetic acid (PubChem CID 61384509) has the molecular formula C11H17NO5S2 and a molecular weight of 307.39 g/mol. Its IUPAC name is 2-[5-[ethyl(2-methoxyethyl)sulfamoyl]thiophen-2-yl]acetic acid.

Molecular Properties

Compound Name2-[5-[ethyl(2-methoxyethyl)sulfamoyl]thiophen-2-yl]acetic acid
PubChem CID61384509
Molecular FormulaC11H17NO5S2
Molecular Weight307.39 g/mol
Exact Mass307.05
IUPAC Name2-[5-[ethyl(2-methoxyethyl)sulfamoyl]thiophen-2-yl]acetic acid
SMILESCCN(CCOC)S(=O)(=O)c1ccc(CC(=O)O)s1
InChIInChI=1S/C11H17NO5S2/c1-3-12(6-7-17-2)19(15,16)11-5-4-9(18-11)8-10(13)14/h4-5H,3,6-8H2,1-2H3,(H,13,14)
InChIKeyYPCSAZURFHXJKZ-UHFFFAOYSA-N
XLogP1.03
TPSA83.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.39
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[5-[2-cyanoethyl(2-methoxyethyl)sulfamoyl]thiophen-2-yl]acetic acid
CID 63285665
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CID 102991763
2-[5-[benzyl(ethyl)sulfamoyl]thiophen-2-yl]acetic acid
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2-[5-[ethyl(thiophen-2-ylmethyl)sulfamoyl]thiophen-2-yl]acetic acid
CID 45298794
N-[[5-[bis(2-methoxyethyl)sulfamoyl]thiophen-2-yl]methyl]acetamide
CID 55364957
2-[5-[2-[2-methoxyethyl(methyl)amino]ethylsulfamoyl]thiophen-2-yl]acetic acid
CID 62844503
2-[5-(2-methoxyethylsulfamoyl)thiophen-2-yl]acetic acid
CID 29045889
2-[5-[ethyl(pyridin-4-yl)sulfamoyl]thiophen-2-yl]acetic acid
CID 104656493
2-[5-[(2-methoxy-2-oxoethyl)-propan-2-ylsulfamoyl]thiophen-2-yl]acetic acid
CID 60952459
5-(2-aminoethyl)-N-ethyl-N-(2-hydroxyethyl)thiophene-2-sulfonamide
CID 54879826
2-[5-[cyclopentyl(methyl)sulfamoyl]thiophen-2-yl]acetic acid
CID 43213263
2-[5-[(2-hydroxy-2-methylpropyl)-methylsulfamoyl]thiophen-2-yl]acetic acid
CID 79386899

Frequently Asked Questions

What is the IUPAC name of 2-[5-[ethyl(2-methoxyethyl)sulfamoyl]thiophen-2-yl]acetic acid?
The IUPAC name of 2-[5-[ethyl(2-methoxyethyl)sulfamoyl]thiophen-2-yl]acetic acid (CID 61384509) is 2-[5-[ethyl(2-methoxyethyl)sulfamoyl]thiophen-2-yl]acetic acid.
What is the SMILES notation for 2-[5-[ethyl(2-methoxyethyl)sulfamoyl]thiophen-2-yl]acetic acid?
The canonical SMILES for 2-[5-[ethyl(2-methoxyethyl)sulfamoyl]thiophen-2-yl]acetic acid is CCN(CCOC)S(=O)(=O)c1ccc(CC(=O)O)s1.
What is the InChIKey of 2-[5-[ethyl(2-methoxyethyl)sulfamoyl]thiophen-2-yl]acetic acid?
The InChIKey is YPCSAZURFHXJKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO5S2/c1-3-12(6-7-17-2)19(15,16)11-5-4-9(18-11)8-10(13)14/h4-5H,3,6-8H2,1-2H3,(H,13,14).
What are the key properties of 2-[5-[ethyl(2-methoxyethyl)sulfamoyl]thiophen-2-yl]acetic acid?
2-[5-[ethyl(2-methoxyethyl)sulfamoyl]thiophen-2-yl]acetic acid has a molecular weight of 307.39 g/mol, XLogP of 1.03, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-[ethyl(2-methoxyethyl)sulfamoyl]thiophen-2-yl]acetic acid is sourced from PubChem (CID 61384509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).