(3R)-1-[(E)-3-phenylprop-2-enyl]piperidin-3-ol

C14H19NO — CID 30981598

IUPAC(3R)-1-[(E)-3-phenylprop-2-enyl]piperidin-3-ol
SMILESO[C@@H]1CCCN(C/C=C/c2ccccc2)C1
InChIInChI=1S/C14H19NO/c16-14-9-5-11-15(12-14)10-4-8-13-6-2-1-3-7-13/h1-4,6-8,14,16H,5,9-12H2/b8-4+/t14-/m1/s1
InChIKeyWPIBOOQKAPNPGU-YOIVXCQUSA-N
MW217.31 g/mol
LogP2.16
Rot. Bonds3

About (3R)-1-[(E)-3-phenylprop-2-enyl]piperidin-3-ol

(3R)-1-[(E)-3-phenylprop-2-enyl]piperidin-3-ol (PubChem CID 30981598) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is (3R)-1-[(E)-3-phenylprop-2-enyl]piperidin-3-ol.

Molecular Properties

Compound Name(3R)-1-[(E)-3-phenylprop-2-enyl]piperidin-3-ol
PubChem CID30981598
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name(3R)-1-[(E)-3-phenylprop-2-enyl]piperidin-3-ol
SMILESO[C@@H]1CCCN(C/C=C/c2ccccc2)C1
InChIInChI=1S/C14H19NO/c16-14-9-5-11-15(12-14)10-4-8-13-6-2-1-3-7-13/h1-4,6-8,14,16H,5,9-12H2/b8-4+/t14-/m1/s1
InChIKeyWPIBOOQKAPNPGU-YOIVXCQUSA-N
XLogP2.16
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-1-[(E)-3-phenylprop-2-enyl]pyrrolidin-3-ol
CID 129368573
[(3R)-1-[(E)-3-phenylprop-2-enyl]piperidin-3-yl]methanol
CID 129367097
2-[1-(3-phenylprop-2-enyl)piperidin-3-yl]acetic acid
CID 76954218
1-[3-(2-nitrophenyl)prop-2-enyl]piperidin-3-ol
CID 2845971
(3R)-N-phenyl-1-[(E)-3-phenylprop-2-enyl]piperidin-3-amine
CID 42463367
1-[(E)-3-phenylprop-2-enyl]azepane
CID 10867670
1-[1-[(E)-3-phenylprop-2-enyl]piperidin-3-yl]ethanamine
CID 63845047
N-[1-[(E)-3-phenylprop-2-enyl]piperidin-3-yl]acetamide
CID 172882645
(3S)-1-[(E)-2-methyl-3-phenylprop-2-enyl]piperidin-3-ol
CID 30981090
1-(3-phenylprop-2-enyl)pyrrolidine-3-carboxylic acid
CID 76985412
1-(2-methyl-3-phenylprop-2-enyl)piperidin-3-ol
CID 127265628
4-[1-[(E)-3-phenylprop-2-enyl]piperidin-3-yl]pyrimidine
CID 74242201

Frequently Asked Questions

What is the IUPAC name of (3R)-1-[(E)-3-phenylprop-2-enyl]piperidin-3-ol?
The IUPAC name of (3R)-1-[(E)-3-phenylprop-2-enyl]piperidin-3-ol (CID 30981598) is (3R)-1-[(E)-3-phenylprop-2-enyl]piperidin-3-ol.
What is the SMILES notation for (3R)-1-[(E)-3-phenylprop-2-enyl]piperidin-3-ol?
The canonical SMILES for (3R)-1-[(E)-3-phenylprop-2-enyl]piperidin-3-ol is O[C@@H]1CCCN(C/C=C/c2ccccc2)C1.
What is the InChIKey of (3R)-1-[(E)-3-phenylprop-2-enyl]piperidin-3-ol?
The InChIKey is WPIBOOQKAPNPGU-YOIVXCQUSA-N. The full InChI is InChI=1S/C14H19NO/c16-14-9-5-11-15(12-14)10-4-8-13-6-2-1-3-7-13/h1-4,6-8,14,16H,5,9-12H2/b8-4+/t14-/m1/s1.
What are the key properties of (3R)-1-[(E)-3-phenylprop-2-enyl]piperidin-3-ol?
(3R)-1-[(E)-3-phenylprop-2-enyl]piperidin-3-ol has a molecular weight of 217.31 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-[(E)-3-phenylprop-2-enyl]piperidin-3-ol is sourced from PubChem (CID 30981598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).