(2R)-1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol

C12H19NO3S — CID 2359827

IUPAC(2R)-1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol
SMILESO[C@@H](COCc1cccs1)CN1CCOCC1
InChIInChI=1S/C12H19NO3S/c14-11(8-13-3-5-15-6-4-13)9-16-10-12-2-1-7-17-12/h1-2,7,11,14H,3-6,8-10H2/t11-/m1/s1
InChIKeyPIZUGWKFLHENED-LLVKDONJSA-N
MW257.35 g/mol
LogP0.96
Rot. Bonds6

About (2R)-1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol

(2R)-1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol (PubChem CID 2359827) has the molecular formula C12H19NO3S and a molecular weight of 257.35 g/mol. Its IUPAC name is (2R)-1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol.

Molecular Properties

Compound Name(2R)-1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol
PubChem CID2359827
Molecular FormulaC12H19NO3S
Molecular Weight257.35 g/mol
Exact Mass257.11
IUPAC Name(2R)-1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol
SMILESO[C@@H](COCc1cccs1)CN1CCOCC1
InChIInChI=1S/C12H19NO3S/c14-11(8-13-3-5-15-6-4-13)9-16-10-12-2-1-7-17-12/h1-2,7,11,14H,3-6,8-10H2/t11-/m1/s1
InChIKeyPIZUGWKFLHENED-LLVKDONJSA-N
XLogP0.96
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.35
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol?
The IUPAC name of (2R)-1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol (CID 2359827) is (2R)-1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol.
What is the SMILES notation for (2R)-1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol?
The canonical SMILES for (2R)-1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol is O[C@@H](COCc1cccs1)CN1CCOCC1.
What is the InChIKey of (2R)-1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol?
The InChIKey is PIZUGWKFLHENED-LLVKDONJSA-N. The full InChI is InChI=1S/C12H19NO3S/c14-11(8-13-3-5-15-6-4-13)9-16-10-12-2-1-7-17-12/h1-2,7,11,14H,3-6,8-10H2/t11-/m1/s1.
What are the key properties of (2R)-1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol?
(2R)-1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol has a molecular weight of 257.35 g/mol, XLogP of 0.96, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol is sourced from PubChem (CID 2359827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).