1-methoxy-3-piperidin-1-ylpropan-2-ol

C9H19NO2 — CID 566986

IUPAC1-methoxy-3-piperidin-1-ylpropan-2-ol
SMILESCOCC(O)CN1CCCCC1
InChIInChI=1S/C9H19NO2/c1-12-8-9(11)7-10-5-3-2-4-6-10/h9,11H,2-8H2,1H3
InChIKeyRCEDQBMKRMXSDJ-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.48
Rot. Bonds4

About 1-methoxy-3-piperidin-1-ylpropan-2-ol

1-methoxy-3-piperidin-1-ylpropan-2-ol (PubChem CID 566986) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 1-methoxy-3-piperidin-1-ylpropan-2-ol.

Molecular Properties

Compound Name1-methoxy-3-piperidin-1-ylpropan-2-ol
PubChem CID566986
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name1-methoxy-3-piperidin-1-ylpropan-2-ol
SMILESCOCC(O)CN1CCCCC1
InChIInChI=1S/C9H19NO2/c1-12-8-9(11)7-10-5-3-2-4-6-10/h9,11H,2-8H2,1H3
InChIKeyRCEDQBMKRMXSDJ-UHFFFAOYSA-N
XLogP0.48
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-3-piperidin-1-ylpropan-2-ol?
The IUPAC name of 1-methoxy-3-piperidin-1-ylpropan-2-ol (CID 566986) is 1-methoxy-3-piperidin-1-ylpropan-2-ol.
What is the SMILES notation for 1-methoxy-3-piperidin-1-ylpropan-2-ol?
The canonical SMILES for 1-methoxy-3-piperidin-1-ylpropan-2-ol is COCC(O)CN1CCCCC1.
What is the InChIKey of 1-methoxy-3-piperidin-1-ylpropan-2-ol?
The InChIKey is RCEDQBMKRMXSDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-12-8-9(11)7-10-5-3-2-4-6-10/h9,11H,2-8H2,1H3.
What are the key properties of 1-methoxy-3-piperidin-1-ylpropan-2-ol?
1-methoxy-3-piperidin-1-ylpropan-2-ol has a molecular weight of 173.26 g/mol, XLogP of 0.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-3-piperidin-1-ylpropan-2-ol is sourced from PubChem (CID 566986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).