(3R)-3-[[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]amino]oxolan-2-one

C14H20N2O3S — CID 95740548

IUPAC(3R)-3-[[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]amino]oxolan-2-one
SMILESO=C1OCC[C@H]1NC[C@H](c1cccs1)N1CCOCC1
InChIInChI=1S/C14H20N2O3S/c17-14-11(3-6-19-14)15-10-12(13-2-1-9-20-13)16-4-7-18-8-5-16/h1-2,9,11-12,15H,3-8,10H2/t11-,12-/m1/s1
InChIKeySRHKLIKZEURXPT-VXGBXAGGSA-N
MW296.39 g/mol
LogP1.03
Rot. Bonds5

About (3R)-3-[[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]amino]oxolan-2-one

(3R)-3-[[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]amino]oxolan-2-one (PubChem CID 95740548) has the molecular formula C14H20N2O3S and a molecular weight of 296.39 g/mol. Its IUPAC name is (3R)-3-[[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]amino]oxolan-2-one.

Molecular Properties

Compound Name(3R)-3-[[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]amino]oxolan-2-one
PubChem CID95740548
Molecular FormulaC14H20N2O3S
Molecular Weight296.39 g/mol
Exact Mass296.12
IUPAC Name(3R)-3-[[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]amino]oxolan-2-one
SMILESO=C1OCC[C@H]1NC[C@H](c1cccs1)N1CCOCC1
InChIInChI=1S/C14H20N2O3S/c17-14-11(3-6-19-14)15-10-12(13-2-1-9-20-13)16-4-7-18-8-5-16/h1-2,9,11-12,15H,3-8,10H2/t11-,12-/m1/s1
InChIKeySRHKLIKZEURXPT-VXGBXAGGSA-N
XLogP1.03
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.39
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (3R)-3-[[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]amino]oxolan-2-one?
The IUPAC name of (3R)-3-[[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]amino]oxolan-2-one (CID 95740548) is (3R)-3-[[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]amino]oxolan-2-one.
What is the SMILES notation for (3R)-3-[[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]amino]oxolan-2-one?
The canonical SMILES for (3R)-3-[[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]amino]oxolan-2-one is O=C1OCC[C@H]1NC[C@H](c1cccs1)N1CCOCC1.
What is the InChIKey of (3R)-3-[[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]amino]oxolan-2-one?
The InChIKey is SRHKLIKZEURXPT-VXGBXAGGSA-N. The full InChI is InChI=1S/C14H20N2O3S/c17-14-11(3-6-19-14)15-10-12(13-2-1-9-20-13)16-4-7-18-8-5-16/h1-2,9,11-12,15H,3-8,10H2/t11-,12-/m1/s1.
What are the key properties of (3R)-3-[[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]amino]oxolan-2-one?
(3R)-3-[[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]amino]oxolan-2-one has a molecular weight of 296.39 g/mol, XLogP of 1.03, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-[[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]amino]oxolan-2-one is sourced from PubChem (CID 95740548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).