N-[2-[(4-cyclopentyloxyphenyl)sulfonylamino]ethyl]-N-(2-methoxyethyl)acetamide

C18H28N2O5S — CID 113053247

IUPACN-[2-[(4-cyclopentyloxyphenyl)sulfonylamino]ethyl]-N-(2-methoxyethyl)acetamide
SMILESCOCCN(CCNS(=O)(=O)c1ccc(OC2CCCC2)cc1)C(C)=O
InChIInChI=1S/C18H28N2O5S/c1-15(21)20(13-14-24-2)12-11-19-26(22,23)18-9-7-17(8-10-18)25-16-5-3-4-6-16/h7-10,16,19H,3-6,11-14H2,1-2H3
InChIKeyHQQDTISIZZYIHC-UHFFFAOYSA-N
MW384.50 g/mol
LogP1.78
Rot. Bonds10

About N-[2-[(4-cyclopentyloxyphenyl)sulfonylamino]ethyl]-N-(2-methoxyethyl)acetamide

N-[2-[(4-cyclopentyloxyphenyl)sulfonylamino]ethyl]-N-(2-methoxyethyl)acetamide (PubChem CID 113053247) has the molecular formula C18H28N2O5S and a molecular weight of 384.50 g/mol. Its IUPAC name is N-[2-[(4-cyclopentyloxyphenyl)sulfonylamino]ethyl]-N-(2-methoxyethyl)acetamide.

Molecular Properties

Compound NameN-[2-[(4-cyclopentyloxyphenyl)sulfonylamino]ethyl]-N-(2-methoxyethyl)acetamide
PubChem CID113053247
Molecular FormulaC18H28N2O5S
Molecular Weight384.50 g/mol
Exact Mass384.17
IUPAC NameN-[2-[(4-cyclopentyloxyphenyl)sulfonylamino]ethyl]-N-(2-methoxyethyl)acetamide
SMILESCOCCN(CCNS(=O)(=O)c1ccc(OC2CCCC2)cc1)C(C)=O
InChIInChI=1S/C18H28N2O5S/c1-15(21)20(13-14-24-2)12-11-19-26(22,23)18-9-7-17(8-10-18)25-16-5-3-4-6-16/h7-10,16,19H,3-6,11-14H2,1-2H3
InChIKeyHQQDTISIZZYIHC-UHFFFAOYSA-N
XLogP1.78
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.50
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-[(4-cyclopentyloxyphenyl)sulfonylamino]ethyl]-N-(2-methoxyethyl)acetamide?
The IUPAC name of N-[2-[(4-cyclopentyloxyphenyl)sulfonylamino]ethyl]-N-(2-methoxyethyl)acetamide (CID 113053247) is N-[2-[(4-cyclopentyloxyphenyl)sulfonylamino]ethyl]-N-(2-methoxyethyl)acetamide.
What is the SMILES notation for N-[2-[(4-cyclopentyloxyphenyl)sulfonylamino]ethyl]-N-(2-methoxyethyl)acetamide?
The canonical SMILES for N-[2-[(4-cyclopentyloxyphenyl)sulfonylamino]ethyl]-N-(2-methoxyethyl)acetamide is COCCN(CCNS(=O)(=O)c1ccc(OC2CCCC2)cc1)C(C)=O.
What is the InChIKey of N-[2-[(4-cyclopentyloxyphenyl)sulfonylamino]ethyl]-N-(2-methoxyethyl)acetamide?
The InChIKey is HQQDTISIZZYIHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O5S/c1-15(21)20(13-14-24-2)12-11-19-26(22,23)18-9-7-17(8-10-18)25-16-5-3-4-6-16/h7-10,16,19H,3-6,11-14H2,1-2H3.
What are the key properties of N-[2-[(4-cyclopentyloxyphenyl)sulfonylamino]ethyl]-N-(2-methoxyethyl)acetamide?
N-[2-[(4-cyclopentyloxyphenyl)sulfonylamino]ethyl]-N-(2-methoxyethyl)acetamide has a molecular weight of 384.50 g/mol, XLogP of 1.78, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(4-cyclopentyloxyphenyl)sulfonylamino]ethyl]-N-(2-methoxyethyl)acetamide is sourced from PubChem (CID 113053247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).