(E)-2-[(2R)-1-methylpiperidin-2-yl]ethenol

C8H15NO — CID 163529259

IUPAC(E)-2-[(2R)-1-methylpiperidin-2-yl]ethenol
SMILESCN1CCCC[C@@H]1/C=C/O
InChIInChI=1S/C8H15NO/c1-9-6-3-2-4-8(9)5-7-10/h5,7-8,10H,2-4,6H2,1H3/b7-5+/t8-/m1/s1
InChIKeyDRMVHGNHANGZDY-WVXIBAHESA-N
MW141.21 g/mol
LogP1.54
Rot. Bonds1

About (E)-2-[(2R)-1-methylpiperidin-2-yl]ethenol

(E)-2-[(2R)-1-methylpiperidin-2-yl]ethenol (PubChem CID 163529259) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is (E)-2-[(2R)-1-methylpiperidin-2-yl]ethenol.

Molecular Properties

Compound Name(E)-2-[(2R)-1-methylpiperidin-2-yl]ethenol
PubChem CID163529259
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name(E)-2-[(2R)-1-methylpiperidin-2-yl]ethenol
SMILESCN1CCCC[C@@H]1/C=C/O
InChIInChI=1S/C8H15NO/c1-9-6-3-2-4-8(9)5-7-10/h5,7-8,10H,2-4,6H2,1H3/b7-5+/t8-/m1/s1
InChIKeyDRMVHGNHANGZDY-WVXIBAHESA-N
XLogP1.54
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (E)-2-[(2R)-1-methylpiperidin-2-yl]ethenol?
The IUPAC name of (E)-2-[(2R)-1-methylpiperidin-2-yl]ethenol (CID 163529259) is (E)-2-[(2R)-1-methylpiperidin-2-yl]ethenol.
What is the SMILES notation for (E)-2-[(2R)-1-methylpiperidin-2-yl]ethenol?
The canonical SMILES for (E)-2-[(2R)-1-methylpiperidin-2-yl]ethenol is CN1CCCC[C@@H]1/C=C/O.
What is the InChIKey of (E)-2-[(2R)-1-methylpiperidin-2-yl]ethenol?
The InChIKey is DRMVHGNHANGZDY-WVXIBAHESA-N. The full InChI is InChI=1S/C8H15NO/c1-9-6-3-2-4-8(9)5-7-10/h5,7-8,10H,2-4,6H2,1H3/b7-5+/t8-/m1/s1.
What are the key properties of (E)-2-[(2R)-1-methylpiperidin-2-yl]ethenol?
(E)-2-[(2R)-1-methylpiperidin-2-yl]ethenol has a molecular weight of 141.21 g/mol, XLogP of 1.54, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-[(2R)-1-methylpiperidin-2-yl]ethenol is sourced from PubChem (CID 163529259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).