[(2R)-1-benzyl-2-methylpiperidin-2-yl]methanol

C14H21NO — CID 97184583

IUPAC[(2R)-1-benzyl-2-methylpiperidin-2-yl]methanol
SMILESC[C@]1(CO)CCCCN1Cc1ccccc1
InChIInChI=1S/C14H21NO/c1-14(12-16)9-5-6-10-15(14)11-13-7-3-2-4-8-13/h2-4,7-8,16H,5-6,9-12H2,1H3/t14-/m1/s1
InChIKeyLLESIGNGEUHSBR-CQSZACIVSA-N
MW219.33 g/mol
LogP2.42
Rot. Bonds3

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

[(2R)-1-benzyl-2-methylpiperidin-2-yl]methanol (PubChem CID 97184583) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is [(2R)-1-benzyl-2-methylpiperidin-2-yl]methanol.

Molecular Properties

Compound Name[(2R)-1-benzyl-2-methylpiperidin-2-yl]methanol
PubChem CID97184583
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name[(2R)-1-benzyl-2-methylpiperidin-2-yl]methanol
SMILESC[C@]1(CO)CCCCN1Cc1ccccc1
InChIInChI=1S/C14H21NO/c1-14(12-16)9-5-6-10-15(14)11-13-7-3-2-4-8-13/h2-4,7-8,16H,5-6,9-12H2,1H3/t14-/m1/s1
InChIKeyLLESIGNGEUHSBR-CQSZACIVSA-N
XLogP2.42
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [(2R)-1-benzyl-2-methylpiperidin-2-yl]methanol?
The IUPAC name of [(2R)-1-benzyl-2-methylpiperidin-2-yl]methanol (CID 97184583) is [(2R)-1-benzyl-2-methylpiperidin-2-yl]methanol.
What is the SMILES notation for [(2R)-1-benzyl-2-methylpiperidin-2-yl]methanol?
The canonical SMILES for [(2R)-1-benzyl-2-methylpiperidin-2-yl]methanol is C[C@]1(CO)CCCCN1Cc1ccccc1.
What is the InChIKey of [(2R)-1-benzyl-2-methylpiperidin-2-yl]methanol?
The InChIKey is LLESIGNGEUHSBR-CQSZACIVSA-N. The full InChI is InChI=1S/C14H21NO/c1-14(12-16)9-5-6-10-15(14)11-13-7-3-2-4-8-13/h2-4,7-8,16H,5-6,9-12H2,1H3/t14-/m1/s1.
What are the key properties of [(2R)-1-benzyl-2-methylpiperidin-2-yl]methanol?
[(2R)-1-benzyl-2-methylpiperidin-2-yl]methanol has a molecular weight of 219.33 g/mol, XLogP of 2.42, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-1-benzyl-2-methylpiperidin-2-yl]methanol is sourced from PubChem (CID 97184583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).