[(2R)-1-benzyl-4-methylidenepiperidin-2-yl]methanol

C14H19NO — CID 66735635

IUPAC[(2R)-1-benzyl-4-methylidenepiperidin-2-yl]methanol
SMILESC=C1CCN(Cc2ccccc2)[C@@H](CO)C1
InChIInChI=1S/C14H19NO/c1-12-7-8-15(14(9-12)11-16)10-13-5-3-2-4-6-13/h2-6,14,16H,1,7-11H2/t14-/m1/s1
InChIKeyRIVIVBOYCOXKID-CQSZACIVSA-N
MW217.31 g/mol
LogP2.20
Rot. Bonds3

About [(2R)-1-benzyl-4-methylidenepiperidin-2-yl]methanol

[(2R)-1-benzyl-4-methylidenepiperidin-2-yl]methanol (PubChem CID 66735635) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is [(2R)-1-benzyl-4-methylidenepiperidin-2-yl]methanol.

Molecular Properties

Compound Name[(2R)-1-benzyl-4-methylidenepiperidin-2-yl]methanol
PubChem CID66735635
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name[(2R)-1-benzyl-4-methylidenepiperidin-2-yl]methanol
SMILESC=C1CCN(Cc2ccccc2)[C@@H](CO)C1
InChIInChI=1S/C14H19NO/c1-12-7-8-15(14(9-12)11-16)10-13-5-3-2-4-6-13/h2-6,14,16H,1,7-11H2/t14-/m1/s1
InChIKeyRIVIVBOYCOXKID-CQSZACIVSA-N
XLogP2.20
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 ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(1,4-dibenzylpiperazin-2-yl)methanol
CID 10827800
[1-[(4-phenylmethoxyphenyl)methyl]piperidin-2-yl]methanol
CID 23961585
(4R)-1-benzyl-4-(hydroxymethyl)azetidin-2-one
CID 10856298
[(2R,4S)-1-benzyl-4-methylpyrrolidin-2-yl]methanol
CID 23248612
[1-benzyl-4-(4,4-dimethylpent-1-en-2-yl)piperazin-2-yl]methanol
CID 166838025
1-benzyl-2-propylpiperidin-4-one
CID 123828340
(2R,3S)-1-benzyl-2-(hydroxymethyl)pyrrolidin-3-ol
CID 10998222
1-hydroxy-4-methylidenepiperidine;phenylmethanol
CID 143591537
[(2R,6S)-1-benzyl-6-(hydroxymethyl)piperidin-2-yl](113C)methanol
CID 59404485
dideuterio-(1,4-dibenzylpiperazin-2-yl)methanol
CID 170598960
2-(1-benzylpyrrolidin-2-yl)ethanol;ethane
CID 142002278
[(2R)-1-benzyl-5-bromo-3,6-dihydro-2H-pyridin-2-yl]methanol
CID 162763302

Frequently Asked Questions

What is the IUPAC name of [(2R)-1-benzyl-4-methylidenepiperidin-2-yl]methanol?
The IUPAC name of [(2R)-1-benzyl-4-methylidenepiperidin-2-yl]methanol (CID 66735635) is [(2R)-1-benzyl-4-methylidenepiperidin-2-yl]methanol.
What is the SMILES notation for [(2R)-1-benzyl-4-methylidenepiperidin-2-yl]methanol?
The canonical SMILES for [(2R)-1-benzyl-4-methylidenepiperidin-2-yl]methanol is C=C1CCN(Cc2ccccc2)[C@@H](CO)C1.
What is the InChIKey of [(2R)-1-benzyl-4-methylidenepiperidin-2-yl]methanol?
The InChIKey is RIVIVBOYCOXKID-CQSZACIVSA-N. The full InChI is InChI=1S/C14H19NO/c1-12-7-8-15(14(9-12)11-16)10-13-5-3-2-4-6-13/h2-6,14,16H,1,7-11H2/t14-/m1/s1.
What are the key properties of [(2R)-1-benzyl-4-methylidenepiperidin-2-yl]methanol?
[(2R)-1-benzyl-4-methylidenepiperidin-2-yl]methanol has a molecular weight of 217.31 g/mol, XLogP of 2.20, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-1-benzyl-4-methylidenepiperidin-2-yl]methanol is sourced from PubChem (CID 66735635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).