(4-benzylpiperidin-2-yl)methanol

C13H19NO — CID 91169099

IUPAC(4-benzylpiperidin-2-yl)methanol
SMILESOCC1CC(Cc2ccccc2)CCN1
InChIInChI=1S/C13H19NO/c15-10-13-9-12(6-7-14-13)8-11-4-2-1-3-5-11/h1-5,12-15H,6-10H2
InChIKeyQMTMZTHPRDKPNW-UHFFFAOYSA-N
MW205.30 g/mol
LogP1.59
Rot. Bonds3

About (4-benzylpiperidin-2-yl)methanol

(4-benzylpiperidin-2-yl)methanol (PubChem CID 91169099) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is (4-benzylpiperidin-2-yl)methanol.

Molecular Properties

Compound Name(4-benzylpiperidin-2-yl)methanol
PubChem CID91169099
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name(4-benzylpiperidin-2-yl)methanol
SMILESOCC1CC(Cc2ccccc2)CCN1
InChIInChI=1S/C13H19NO/c15-10-13-9-12(6-7-14-13)8-11-4-2-1-3-5-11/h1-5,12-15H,6-10H2
InChIKeyQMTMZTHPRDKPNW-UHFFFAOYSA-N
XLogP1.59
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R,4R)-2,4-dibenzylpiperidine
CID 101092769
[4-(2-phenylethyl)piperidin-2-yl]methanol
CID 117000550
(5-benzylpiperidin-2-yl)methanol
CID 117000443
1-[[(2S,4R)-4-benzylpiperidin-2-yl]methyl]-3-phenylurea
CID 22966123
diethyl 2-[(4-benzylpiperidin-2-yl)methyl]propanedioate
CID 18621453
diethyl 2-[(4-benzylpiperidin-2-yl)methyl]propanedioate;hydrochloride
CID 18621452
5-benzyldiazepane
CID 154443129
[(2S,3S)-3-benzylpyrrolidin-2-yl]methanol
CID 130754239
(2S)-2-benzylazetidine;molecular hydrogen
CID 145023089
1-[[(2S,4S)-4-benzylpiperidin-2-yl]methyl]-3-(3-chlorophenyl)urea
CID 22966138
1-[[(2S,4S)-4-benzylpiperidin-2-yl]methyl]-3-(3-fluorophenyl)urea
CID 22966146
1-(3-acetylphenyl)-3-[[(2R,4S)-4-benzylpiperidin-2-yl]methyl]urea
CID 142001085

Frequently Asked Questions

What is the IUPAC name of (4-benzylpiperidin-2-yl)methanol?
The IUPAC name of (4-benzylpiperidin-2-yl)methanol (CID 91169099) is (4-benzylpiperidin-2-yl)methanol.
What is the SMILES notation for (4-benzylpiperidin-2-yl)methanol?
The canonical SMILES for (4-benzylpiperidin-2-yl)methanol is OCC1CC(Cc2ccccc2)CCN1.
What is the InChIKey of (4-benzylpiperidin-2-yl)methanol?
The InChIKey is QMTMZTHPRDKPNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c15-10-13-9-12(6-7-14-13)8-11-4-2-1-3-5-11/h1-5,12-15H,6-10H2.
What are the key properties of (4-benzylpiperidin-2-yl)methanol?
(4-benzylpiperidin-2-yl)methanol has a molecular weight of 205.30 g/mol, XLogP of 1.59, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-benzylpiperidin-2-yl)methanol is sourced from PubChem (CID 91169099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).