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

C18H27N3O3S — CID 20866332

IUPACN-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-oxo-2-piperidin-1-ylacetamide
SMILESCC(NC(=O)C(=O)N1CCCCC1)C(c1cccs1)N1CCOCC1
InChIInChI=1S/C18H27N3O3S/c1-14(19-17(22)18(23)21-7-3-2-4-8-21)16(15-6-5-13-25-15)20-9-11-24-12-10-20/h5-6,13-14,16H,2-4,7-12H2,1H3,(H,19,22)
InChIKeyLHJKKFQTCXBPOB-UHFFFAOYSA-N
MW365.50 g/mol
LogP1.64
Rot. Bonds4

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

N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-oxo-2-piperidin-1-ylacetamide (PubChem CID 20866332) has the molecular formula C18H27N3O3S and a molecular weight of 365.50 g/mol. Its IUPAC name is N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-oxo-2-piperidin-1-ylacetamide.

Molecular Properties

Compound NameN-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-oxo-2-piperidin-1-ylacetamide
PubChem CID20866332
Molecular FormulaC18H27N3O3S
Molecular Weight365.50 g/mol
Exact Mass365.18
IUPAC NameN-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-oxo-2-piperidin-1-ylacetamide
SMILESCC(NC(=O)C(=O)N1CCCCC1)C(c1cccs1)N1CCOCC1
InChIInChI=1S/C18H27N3O3S/c1-14(19-17(22)18(23)21-7-3-2-4-8-21)16(15-6-5-13-25-15)20-9-11-24-12-10-20/h5-6,13-14,16H,2-4,7-12H2,1H3,(H,19,22)
InChIKeyLHJKKFQTCXBPOB-UHFFFAOYSA-N
XLogP1.64
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.50
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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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-oxo-2-piperidin-1-ylacetamide?
The IUPAC name of N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-oxo-2-piperidin-1-ylacetamide (CID 20866332) is N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-oxo-2-piperidin-1-ylacetamide.
What is the SMILES notation for N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-oxo-2-piperidin-1-ylacetamide?
The canonical SMILES for N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-oxo-2-piperidin-1-ylacetamide is CC(NC(=O)C(=O)N1CCCCC1)C(c1cccs1)N1CCOCC1.
What is the InChIKey of N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-oxo-2-piperidin-1-ylacetamide?
The InChIKey is LHJKKFQTCXBPOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3O3S/c1-14(19-17(22)18(23)21-7-3-2-4-8-21)16(15-6-5-13-25-15)20-9-11-24-12-10-20/h5-6,13-14,16H,2-4,7-12H2,1H3,(H,19,22).
What are the key properties of N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-oxo-2-piperidin-1-ylacetamide?
N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)-2-oxo-2-piperidin-1-ylacetamide has a molecular weight of 365.50 g/mol, XLogP of 1.64, 4 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-oxo-2-piperidin-1-ylacetamide is sourced from PubChem (CID 20866332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).