N'-(4,5-dihydro-1,3-thiazol-2-yl)-N-(2-morpholin-4-ylethyl)oxamide

C11H18N4O3S — CID 108517574

IUPACN'-(4,5-dihydro-1,3-thiazol-2-yl)-N-(2-morpholin-4-ylethyl)oxamide
SMILESO=C(NCCN1CCOCC1)C(=O)NC1=NCCS1
InChIInChI=1S/C11H18N4O3S/c16-9(10(17)14-11-13-2-8-19-11)12-1-3-15-4-6-18-7-5-15/h1-8H2,(H,12,16)(H,13,14,17)
InChIKeyIUYMNWDMTRBICS-UHFFFAOYSA-N
MW286.36 g/mol
LogP-1.35
Rot. Bonds3

About N'-(4,5-dihydro-1,3-thiazol-2-yl)-N-(2-morpholin-4-ylethyl)oxamide

N'-(4,5-dihydro-1,3-thiazol-2-yl)-N-(2-morpholin-4-ylethyl)oxamide (PubChem CID 108517574) has the molecular formula C11H18N4O3S and a molecular weight of 286.36 g/mol. Its IUPAC name is N'-(4,5-dihydro-1,3-thiazol-2-yl)-N-(2-morpholin-4-ylethyl)oxamide.

Molecular Properties

Compound NameN'-(4,5-dihydro-1,3-thiazol-2-yl)-N-(2-morpholin-4-ylethyl)oxamide
PubChem CID108517574
Molecular FormulaC11H18N4O3S
Molecular Weight286.36 g/mol
Exact Mass286.11
IUPAC NameN'-(4,5-dihydro-1,3-thiazol-2-yl)-N-(2-morpholin-4-ylethyl)oxamide
SMILESO=C(NCCN1CCOCC1)C(=O)NC1=NCCS1
InChIInChI=1S/C11H18N4O3S/c16-9(10(17)14-11-13-2-8-19-11)12-1-3-15-4-6-18-7-5-15/h1-8H2,(H,12,16)(H,13,14,17)
InChIKeyIUYMNWDMTRBICS-UHFFFAOYSA-N
XLogP-1.35
TPSA83.03 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.36
LogP ≤ 5-1.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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'-(4,5-dihydro-1,3-thiazol-2-yl)-N-(2-morpholin-4-ylethyl)oxamide?
The IUPAC name of N'-(4,5-dihydro-1,3-thiazol-2-yl)-N-(2-morpholin-4-ylethyl)oxamide (CID 108517574) is N'-(4,5-dihydro-1,3-thiazol-2-yl)-N-(2-morpholin-4-ylethyl)oxamide.
What is the SMILES notation for N'-(4,5-dihydro-1,3-thiazol-2-yl)-N-(2-morpholin-4-ylethyl)oxamide?
The canonical SMILES for N'-(4,5-dihydro-1,3-thiazol-2-yl)-N-(2-morpholin-4-ylethyl)oxamide is O=C(NCCN1CCOCC1)C(=O)NC1=NCCS1.
What is the InChIKey of N'-(4,5-dihydro-1,3-thiazol-2-yl)-N-(2-morpholin-4-ylethyl)oxamide?
The InChIKey is IUYMNWDMTRBICS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O3S/c16-9(10(17)14-11-13-2-8-19-11)12-1-3-15-4-6-18-7-5-15/h1-8H2,(H,12,16)(H,13,14,17).
What are the key properties of N'-(4,5-dihydro-1,3-thiazol-2-yl)-N-(2-morpholin-4-ylethyl)oxamide?
N'-(4,5-dihydro-1,3-thiazol-2-yl)-N-(2-morpholin-4-ylethyl)oxamide has a molecular weight of 286.36 g/mol, XLogP of -1.35, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4,5-dihydro-1,3-thiazol-2-yl)-N-(2-morpholin-4-ylethyl)oxamide is sourced from PubChem (CID 108517574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).