(5-benzylpiperidin-2-yl)methanol

C13H19NO — CID 117000443

IUPAC(5-benzylpiperidin-2-yl)methanol
SMILESOCC1CCC(Cc2ccccc2)CN1
InChIInChI=1S/C13H19NO/c15-10-13-7-6-12(9-14-13)8-11-4-2-1-3-5-11/h1-5,12-15H,6-10H2
InChIKeyBCLKIHAAHMSPQJ-UHFFFAOYSA-N
MW205.30 g/mol
LogP1.59
Rot. Bonds3

About (5-benzylpiperidin-2-yl)methanol

(5-benzylpiperidin-2-yl)methanol (PubChem CID 117000443) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is (5-benzylpiperidin-2-yl)methanol.

Molecular Properties

Compound Name(5-benzylpiperidin-2-yl)methanol
PubChem CID117000443
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name(5-benzylpiperidin-2-yl)methanol
SMILESOCC1CCC(Cc2ccccc2)CN1
InChIInChI=1S/C13H19NO/c15-10-13-7-6-12(9-14-13)8-11-4-2-1-3-5-11/h1-5,12-15H,6-10H2
InChIKeyBCLKIHAAHMSPQJ-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

(2S,5R)-5-benzyl-2-methylpiperidine
CID 130765176
(4-benzylpiperidin-2-yl)methanol
CID 91169099
2-(5-benzylpiperidin-2-yl)ethylurea
CID 142001060
(2R,5S)-2-benzyl-5-(cyclopropylmethoxy)piperidine
CID 129201695
(3S,6S)-3-benzyl-6-(hydroxymethyl)piperidin-2-one
CID 11830950
[5-(aminomethyl)piperidin-2-yl]methanol
CID 170157404
1-[[(2S,5S)-5-benzylpiperidin-2-yl]methyl]-3-(3-chlorophenyl)urea
CID 22966140
cyclopropylmethylbenzene;ethane;methane
CID 142248267
4-[[(2R,5R)-5-benzylpiperazin-2-yl]methyl]phenol
CID 171358745
3-benzylazetidine;hydrochloride
CID 54592835
(2R,4R)-2,4-dibenzylpiperidine
CID 101092769
5-benzyldiazepane
CID 154443129

Frequently Asked Questions

What is the IUPAC name of (5-benzylpiperidin-2-yl)methanol?
The IUPAC name of (5-benzylpiperidin-2-yl)methanol (CID 117000443) is (5-benzylpiperidin-2-yl)methanol.
What is the SMILES notation for (5-benzylpiperidin-2-yl)methanol?
The canonical SMILES for (5-benzylpiperidin-2-yl)methanol is OCC1CCC(Cc2ccccc2)CN1.
What is the InChIKey of (5-benzylpiperidin-2-yl)methanol?
The InChIKey is BCLKIHAAHMSPQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c15-10-13-7-6-12(9-14-13)8-11-4-2-1-3-5-11/h1-5,12-15H,6-10H2.
What are the key properties of (5-benzylpiperidin-2-yl)methanol?
(5-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 (5-benzylpiperidin-2-yl)methanol is sourced from PubChem (CID 117000443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).