N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-thiophen-2-ylacetamide

C17H22N2O2S2 — CID 3237199

IUPACN-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-thiophen-2-ylacetamide
SMILESCC(NC(=O)Cc1cccs1)C(c1cccs1)N1CCOCC1
InChIInChI=1S/C17H22N2O2S2/c1-13(18-16(20)12-14-4-2-10-22-14)17(15-5-3-11-23-15)19-6-8-21-9-7-19/h2-5,10-11,13,17H,6-9,12H2,1H3,(H,18,20)
InChIKeyVKEVLQVGGSKRQI-UHFFFAOYSA-N
MW350.51 g/mol
LogP2.93
Rot. Bonds6

About N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-thiophen-2-ylacetamide

N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-thiophen-2-ylacetamide (PubChem CID 3237199) has the molecular formula C17H22N2O2S2 and a molecular weight of 350.51 g/mol. Its IUPAC name is N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-thiophen-2-ylacetamide
PubChem CID3237199
Molecular FormulaC17H22N2O2S2
Molecular Weight350.51 g/mol
Exact Mass350.11
IUPAC NameN-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-thiophen-2-ylacetamide
SMILESCC(NC(=O)Cc1cccs1)C(c1cccs1)N1CCOCC1
InChIInChI=1S/C17H22N2O2S2/c1-13(18-16(20)12-14-4-2-10-22-14)17(15-5-3-11-23-15)19-6-8-21-9-7-19/h2-5,10-11,13,17H,6-9,12H2,1H3,(H,18,20)
InChIKeyVKEVLQVGGSKRQI-UHFFFAOYSA-N
XLogP2.93
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.51
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-thiophen-2-ylacetamide?
The IUPAC name of N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-thiophen-2-ylacetamide (CID 3237199) is N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-thiophen-2-ylacetamide?
The canonical SMILES for N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-thiophen-2-ylacetamide is CC(NC(=O)Cc1cccs1)C(c1cccs1)N1CCOCC1.
What is the InChIKey of N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-thiophen-2-ylacetamide?
The InChIKey is VKEVLQVGGSKRQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2S2/c1-13(18-16(20)12-14-4-2-10-22-14)17(15-5-3-11-23-15)19-6-8-21-9-7-19/h2-5,10-11,13,17H,6-9,12H2,1H3,(H,18,20).
What are the key properties of N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-thiophen-2-ylacetamide?
N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-thiophen-2-ylacetamide has a molecular weight of 350.51 g/mol, XLogP of 2.93, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-thiophen-2-ylacetamide is sourced from PubChem (CID 3237199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).