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

C12H19NO3S — CID 4115294

IUPAC1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol
SMILESOC(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
InChIKeyPIZUGWKFLHENED-UHFFFAOYSA-N
MW257.35 g/mol
LogP0.96
Rot. Bonds6

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

1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol (PubChem CID 4115294) has the molecular formula C12H19NO3S and a molecular weight of 257.35 g/mol. Its IUPAC name is 1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol.

Molecular Properties

Compound Name1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol
PubChem CID4115294
Molecular FormulaC12H19NO3S
Molecular Weight257.35 g/mol
Exact Mass257.11
IUPAC Name1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol
SMILESOC(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
InChIKeyPIZUGWKFLHENED-UHFFFAOYSA-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

Analyze 1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol?
The IUPAC name of 1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol (CID 4115294) is 1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol.
What is the SMILES notation for 1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol?
The canonical SMILES for 1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol is OC(COCc1cccs1)CN1CCOCC1.
What is the InChIKey of 1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol?
The InChIKey is PIZUGWKFLHENED-UHFFFAOYSA-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.
What are the key properties of 1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol?
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 1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol is sourced from PubChem (CID 4115294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).