1-methoxy-3-(2,2,3,3-tetramethylpiperidin-1-yl)propan-2-ol

C13H27NO2 — CID 154252823

IUPAC1-methoxy-3-(2,2,3,3-tetramethylpiperidin-1-yl)propan-2-ol
SMILESCOCC(O)CN1CCCC(C)(C)C1(C)C
InChIInChI=1S/C13H27NO2/c1-12(2)7-6-8-14(13(12,3)4)9-11(15)10-16-5/h11,15H,6-10H2,1-5H3
InChIKeyZWELYKCDTAKZOY-UHFFFAOYSA-N
MW229.36 g/mol
LogP1.89
Rot. Bonds4

About 1-methoxy-3-(2,2,3,3-tetramethylpiperidin-1-yl)propan-2-ol

1-methoxy-3-(2,2,3,3-tetramethylpiperidin-1-yl)propan-2-ol (PubChem CID 154252823) has the molecular formula C13H27NO2 and a molecular weight of 229.36 g/mol. Its IUPAC name is 1-methoxy-3-(2,2,3,3-tetramethylpiperidin-1-yl)propan-2-ol.

Molecular Properties

Compound Name1-methoxy-3-(2,2,3,3-tetramethylpiperidin-1-yl)propan-2-ol
PubChem CID154252823
Molecular FormulaC13H27NO2
Molecular Weight229.36 g/mol
Exact Mass229.20
IUPAC Name1-methoxy-3-(2,2,3,3-tetramethylpiperidin-1-yl)propan-2-ol
SMILESCOCC(O)CN1CCCC(C)(C)C1(C)C
InChIInChI=1S/C13H27NO2/c1-12(2)7-6-8-14(13(12,3)4)9-11(15)10-16-5/h11,15H,6-10H2,1-5H3
InChIKeyZWELYKCDTAKZOY-UHFFFAOYSA-N
XLogP1.89
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
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 1-methoxy-3-(2,2,3,3-tetramethylpiperidin-1-yl)propan-2-ol?
The IUPAC name of 1-methoxy-3-(2,2,3,3-tetramethylpiperidin-1-yl)propan-2-ol (CID 154252823) is 1-methoxy-3-(2,2,3,3-tetramethylpiperidin-1-yl)propan-2-ol.
What is the SMILES notation for 1-methoxy-3-(2,2,3,3-tetramethylpiperidin-1-yl)propan-2-ol?
The canonical SMILES for 1-methoxy-3-(2,2,3,3-tetramethylpiperidin-1-yl)propan-2-ol is COCC(O)CN1CCCC(C)(C)C1(C)C.
What is the InChIKey of 1-methoxy-3-(2,2,3,3-tetramethylpiperidin-1-yl)propan-2-ol?
The InChIKey is ZWELYKCDTAKZOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO2/c1-12(2)7-6-8-14(13(12,3)4)9-11(15)10-16-5/h11,15H,6-10H2,1-5H3.
What are the key properties of 1-methoxy-3-(2,2,3,3-tetramethylpiperidin-1-yl)propan-2-ol?
1-methoxy-3-(2,2,3,3-tetramethylpiperidin-1-yl)propan-2-ol has a molecular weight of 229.36 g/mol, XLogP of 1.89, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-3-(2,2,3,3-tetramethylpiperidin-1-yl)propan-2-ol is sourced from PubChem (CID 154252823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).