2,2-dimethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-ol

C13H27NO2 — CID 102745863

IUPAC2,2-dimethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-ol
SMILESCC(C)(CO)CN1CC(C)(C)OC(C)(C)C1
InChIInChI=1S/C13H27NO2/c1-11(2,10-15)7-14-8-12(3,4)16-13(5,6)9-14/h15H,7-10H2,1-6H3
InChIKeyRHXHAFNYFMFSMQ-UHFFFAOYSA-N
MW229.36 g/mol
LogP1.89
Rot. Bonds3

About 2,2-dimethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-ol

2,2-dimethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-ol (PubChem CID 102745863) has the molecular formula C13H27NO2 and a molecular weight of 229.36 g/mol. Its IUPAC name is 2,2-dimethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-ol.

Molecular Properties

Compound Name2,2-dimethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-ol
PubChem CID102745863
Molecular FormulaC13H27NO2
Molecular Weight229.36 g/mol
Exact Mass229.20
IUPAC Name2,2-dimethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-ol
SMILESCC(C)(CO)CN1CC(C)(C)OC(C)(C)C1
InChIInChI=1S/C13H27NO2/c1-11(2,10-15)7-14-8-12(3,4)16-13(5,6)9-14/h15H,7-10H2,1-6H3
InChIKeyRHXHAFNYFMFSMQ-UHFFFAOYSA-N
XLogP1.89
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.36
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-ol?
The IUPAC name of 2,2-dimethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-ol (CID 102745863) is 2,2-dimethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-ol.
What is the SMILES notation for 2,2-dimethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-ol?
The canonical SMILES for 2,2-dimethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-ol is CC(C)(CO)CN1CC(C)(C)OC(C)(C)C1.
What is the InChIKey of 2,2-dimethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-ol?
The InChIKey is RHXHAFNYFMFSMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO2/c1-11(2,10-15)7-14-8-12(3,4)16-13(5,6)9-14/h15H,7-10H2,1-6H3.
What are the key properties of 2,2-dimethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-ol?
2,2-dimethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-ol has a molecular weight of 229.36 g/mol, XLogP of 1.89, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-ol is sourced from PubChem (CID 102745863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).