N-(3-methoxypropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide

C14H22N2O5S2 — CID 25163284

IUPACN-(3-methoxypropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide
SMILESCOCCCNC(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1
InChIInChI=1S/C14H22N2O5S2/c1-20-8-2-5-15-13(17)11-12-3-4-14(22-12)23(18,19)16-6-9-21-10-7-16/h3-4H,2,5-11H2,1H3,(H,15,17)
InChIKeyVTFZFZUIFJDAFG-UHFFFAOYSA-N
MW362.47 g/mol
LogP0.46
Rot. Bonds8

About N-(3-methoxypropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide

N-(3-methoxypropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide (PubChem CID 25163284) has the molecular formula C14H22N2O5S2 and a molecular weight of 362.47 g/mol. Its IUPAC name is N-(3-methoxypropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide.

Molecular Properties

Compound NameN-(3-methoxypropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide
PubChem CID25163284
Molecular FormulaC14H22N2O5S2
Molecular Weight362.47 g/mol
Exact Mass362.10
IUPAC NameN-(3-methoxypropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide
SMILESCOCCCNC(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1
InChIInChI=1S/C14H22N2O5S2/c1-20-8-2-5-15-13(17)11-12-3-4-14(22-12)23(18,19)16-6-9-21-10-7-16/h3-4H,2,5-11H2,1H3,(H,15,17)
InChIKeyVTFZFZUIFJDAFG-UHFFFAOYSA-N
XLogP0.46
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.47
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(5-methylhexan-2-yl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide
CID 24819930
N-ethyl-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide
CID 25161681
2-(5-morpholin-4-ylsulfonylthiophen-2-yl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
CID 24979626
2-(5-morpholin-4-ylsulfonylthiophen-2-yl)-N-[(4-sulfamoylphenyl)methyl]acetamide
CID 24982549
2-(5-morpholin-4-ylsulfonylthiophen-2-yl)-N-prop-2-enylacetamide
CID 25163602
N-[2-(morpholin-4-yl)ethyl]-2-(thiophen-2-yl)acetamide
CID 670829
N-(cyclohexylmethyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide
CID 2117005
1-Morpholin-4-yl-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)ethanone
CID 2365878
2-(5-morpholin-4-ylsulfonylthiophen-2-yl)-N-pentan-3-ylacetamide
CID 2549966
N-cyclohexyl-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide
CID 8713390
Methyl 3-[[2-(5-piperidin-1-ylsulfonylthiophen-2-yl)acetyl]amino]propanoate
CID 9467537
N-[2-(4-fluorophenyl)ethyl]-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide
CID 24979000

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxypropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide?
The IUPAC name of N-(3-methoxypropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide (CID 25163284) is N-(3-methoxypropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide.
What is the SMILES notation for N-(3-methoxypropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide?
The canonical SMILES for N-(3-methoxypropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide is COCCCNC(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1.
What is the InChIKey of N-(3-methoxypropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide?
The InChIKey is VTFZFZUIFJDAFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O5S2/c1-20-8-2-5-15-13(17)11-12-3-4-14(22-12)23(18,19)16-6-9-21-10-7-16/h3-4H,2,5-11H2,1H3,(H,15,17).
What are the key properties of N-(3-methoxypropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide?
N-(3-methoxypropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide has a molecular weight of 362.47 g/mol, XLogP of 0.46, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxypropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide is sourced from PubChem (CID 25163284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).