6-(2,2,6-trimethylmorpholin-4-yl)hexan-3-ol

C13H27NO2 — CID 106802367

IUPAC6-(2,2,6-trimethylmorpholin-4-yl)hexan-3-ol
SMILESCCC(O)CCCN1CC(C)OC(C)(C)C1
InChIInChI=1S/C13H27NO2/c1-5-12(15)7-6-8-14-9-11(2)16-13(3,4)10-14/h11-12,15H,5-10H2,1-4H3
InChIKeyHQPPQEMQGIFJBE-UHFFFAOYSA-N
MW229.36 g/mol
LogP2.04
Rot. Bonds5

About 6-(2,2,6-trimethylmorpholin-4-yl)hexan-3-ol

6-(2,2,6-trimethylmorpholin-4-yl)hexan-3-ol (PubChem CID 106802367) has the molecular formula C13H27NO2 and a molecular weight of 229.36 g/mol. Its IUPAC name is 6-(2,2,6-trimethylmorpholin-4-yl)hexan-3-ol.

Molecular Properties

Compound Name6-(2,2,6-trimethylmorpholin-4-yl)hexan-3-ol
PubChem CID106802367
Molecular FormulaC13H27NO2
Molecular Weight229.36 g/mol
Exact Mass229.20
IUPAC Name6-(2,2,6-trimethylmorpholin-4-yl)hexan-3-ol
SMILESCCC(O)CCCN1CC(C)OC(C)(C)C1
InChIInChI=1S/C13H27NO2/c1-5-12(15)7-6-8-14-9-11(2)16-13(3,4)10-14/h11-12,15H,5-10H2,1-4H3
InChIKeyHQPPQEMQGIFJBE-UHFFFAOYSA-N
XLogP2.04
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.36
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-(2,2,6-trimethylmorpholin-4-yl)hexan-3-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 6-(2,2,6-trimethylmorpholin-4-yl)hexan-3-ol?
The IUPAC name of 6-(2,2,6-trimethylmorpholin-4-yl)hexan-3-ol (CID 106802367) is 6-(2,2,6-trimethylmorpholin-4-yl)hexan-3-ol.
What is the SMILES notation for 6-(2,2,6-trimethylmorpholin-4-yl)hexan-3-ol?
The canonical SMILES for 6-(2,2,6-trimethylmorpholin-4-yl)hexan-3-ol is CCC(O)CCCN1CC(C)OC(C)(C)C1.
What is the InChIKey of 6-(2,2,6-trimethylmorpholin-4-yl)hexan-3-ol?
The InChIKey is HQPPQEMQGIFJBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO2/c1-5-12(15)7-6-8-14-9-11(2)16-13(3,4)10-14/h11-12,15H,5-10H2,1-4H3.
What are the key properties of 6-(2,2,6-trimethylmorpholin-4-yl)hexan-3-ol?
6-(2,2,6-trimethylmorpholin-4-yl)hexan-3-ol has a molecular weight of 229.36 g/mol, XLogP of 2.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,2,6-trimethylmorpholin-4-yl)hexan-3-ol is sourced from PubChem (CID 106802367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).