(5-methoxypiperidin-3-yl)methanol

C7H15NO2 — CID 166104648

IUPAC(5-methoxypiperidin-3-yl)methanol
SMILESCOC1CNCC(CO)C1
InChIInChI=1S/C7H15NO2/c1-10-7-2-6(5-9)3-8-4-7/h6-9H,2-5H2,1H3
InChIKeyZZKYHLAMAOJLML-UHFFFAOYSA-N
MW145.20 g/mol
LogP-0.40
Rot. Bonds2

About (5-methoxypiperidin-3-yl)methanol

(5-methoxypiperidin-3-yl)methanol (PubChem CID 166104648) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is (5-methoxypiperidin-3-yl)methanol.

Molecular Properties

Compound Name(5-methoxypiperidin-3-yl)methanol
PubChem CID166104648
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Name(5-methoxypiperidin-3-yl)methanol
SMILESCOC1CNCC(CO)C1
InChIInChI=1S/C7H15NO2/c1-10-7-2-6(5-9)3-8-4-7/h6-9H,2-5H2,1H3
InChIKeyZZKYHLAMAOJLML-UHFFFAOYSA-N
XLogP-0.40
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 5-0.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Afegostat
CID 447607
5-(Hydroxymethyl)piperidine-3,4-diol
CID 4452693
(2R/S,3S,4R,5R)-5-(Hydroxymethyl)piperidine-2,3,4-triol
CID 10197840
D-Galacto-Isofagomine
CID 10240946
(2r,3s,4r,5r)-5-(Hydroxymethyl)piperidine-2,3,4-Triol
CID 11987879
5-epi-Isofagomine
CID 10820691
(3S,4S,5S)-5-(Hydroxymethyl)piperidine-3,4-diol
CID 44578588
(3R,4S,5R,6R)-5-(hydroxymethyl)-6-methylpiperidine-3,4-diol
CID 101735280
(S)-5-Methyl-piperidine-3,4-diol
CID 44319486
(3R,4R,5R)-5-(1-hydroxyethyl)piperidine-3,4-diol
CID 51356185
3-(Hydroxymethyl)piperidin-4-ol
CID 10419215
(3S,4S,5R)-5-(Hydroxymethyl)piperidine-3,4-diol
CID 15235482

Frequently Asked Questions

What is the IUPAC name of (5-methoxypiperidin-3-yl)methanol?
The IUPAC name of (5-methoxypiperidin-3-yl)methanol (CID 166104648) is (5-methoxypiperidin-3-yl)methanol.
What is the SMILES notation for (5-methoxypiperidin-3-yl)methanol?
The canonical SMILES for (5-methoxypiperidin-3-yl)methanol is COC1CNCC(CO)C1.
What is the InChIKey of (5-methoxypiperidin-3-yl)methanol?
The InChIKey is ZZKYHLAMAOJLML-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2/c1-10-7-2-6(5-9)3-8-4-7/h6-9H,2-5H2,1H3.
What are the key properties of (5-methoxypiperidin-3-yl)methanol?
(5-methoxypiperidin-3-yl)methanol has a molecular weight of 145.20 g/mol, XLogP of -0.40, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methoxypiperidin-3-yl)methanol is sourced from PubChem (CID 166104648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).