(3R,4R)-4-ethenyl-1-methylpiperidin-3-ol

C8H15NO — CID 167468854

IUPAC(3R,4R)-4-ethenyl-1-methylpiperidin-3-ol
SMILESC=C[C@H]1CCN(C)C[C@@H]1O
InChIInChI=1S/C8H15NO/c1-3-7-4-5-9(2)6-8(7)10/h3,7-8,10H,1,4-6H2,2H3/t7-,8-/m0/s1
InChIKeyCRGMKEFOPRZWNY-YUMQZZPRSA-N
MW141.21 g/mol
LogP0.49
Rot. Bonds1

About (3R,4R)-4-ethenyl-1-methylpiperidin-3-ol

(3R,4R)-4-ethenyl-1-methylpiperidin-3-ol (PubChem CID 167468854) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is (3R,4R)-4-ethenyl-1-methylpiperidin-3-ol.

Molecular Properties

Compound Name(3R,4R)-4-ethenyl-1-methylpiperidin-3-ol
PubChem CID167468854
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name(3R,4R)-4-ethenyl-1-methylpiperidin-3-ol
SMILESC=C[C@H]1CCN(C)C[C@@H]1O
InChIInChI=1S/C8H15NO/c1-3-7-4-5-9(2)6-8(7)10/h3,7-8,10H,1,4-6H2,2H3/t7-,8-/m0/s1
InChIKeyCRGMKEFOPRZWNY-YUMQZZPRSA-N
XLogP0.49
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 ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze (3R,4R)-4-ethenyl-1-methylpiperidin-3-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(3-Cyclohexen-1-ylmethyl)-3-piperidinol
CID 2845911
2,2,2-Trifluoro-1-(1-pent-4-enylpiperidin-4-yl)ethanol
CID 112327040
1-[4-(2,2,2-Trifluoro-1-hydroxyethyl)piperidin-1-yl]hex-5-en-2-ol
CID 112327089
4-[(E)-1-hydroxy-3-iodoprop-2-enyl]-1-methylpiperidin-3-ol
CID 20696713
1-Methyl-3-prop-2-enylpiperidin-4-ol
CID 59827004
actinium;4-[(E)-1-hydroxy-3-iodoprop-2-enyl]-1-(114C)methylpiperidin-3-ol
CID 59971187
4-[(E)-1-hydroxy-3-iodoprop-2-enyl]-1-(114C)methylpiperidin-3-ol
CID 59971188
actinium;4-[(E)-1-hydroxy-3-(123I)iodoprop-2-enyl]-1-methylpiperidin-3-ol
CID 59971189
actinium;4-[(E)-1-hydroxy-3-iodoprop-2-enyl]-1-(114C)methylpiperidin-3-ol
CID 59971192
1-But-3-enylpiperidin-3-ol
CID 64300040
(1-Methyl-3-methylidenepiperidin-4-yl)methanol
CID 68317478
1-Piperidin-1-ylpent-4-en-2-ol
CID 70538589

Frequently Asked Questions

What is the IUPAC name of (3R,4R)-4-ethenyl-1-methylpiperidin-3-ol?
The IUPAC name of (3R,4R)-4-ethenyl-1-methylpiperidin-3-ol (CID 167468854) is (3R,4R)-4-ethenyl-1-methylpiperidin-3-ol.
What is the SMILES notation for (3R,4R)-4-ethenyl-1-methylpiperidin-3-ol?
The canonical SMILES for (3R,4R)-4-ethenyl-1-methylpiperidin-3-ol is C=C[C@H]1CCN(C)C[C@@H]1O.
What is the InChIKey of (3R,4R)-4-ethenyl-1-methylpiperidin-3-ol?
The InChIKey is CRGMKEFOPRZWNY-YUMQZZPRSA-N. The full InChI is InChI=1S/C8H15NO/c1-3-7-4-5-9(2)6-8(7)10/h3,7-8,10H,1,4-6H2,2H3/t7-,8-/m0/s1.
What are the key properties of (3R,4R)-4-ethenyl-1-methylpiperidin-3-ol?
(3R,4R)-4-ethenyl-1-methylpiperidin-3-ol has a molecular weight of 141.21 g/mol, XLogP of 0.49, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4R)-4-ethenyl-1-methylpiperidin-3-ol is sourced from PubChem (CID 167468854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).