1-benzyl-3-propylpiperidin-4-ol

C15H23NO — CID 23003650

IUPAC1-benzyl-3-propylpiperidin-4-ol
SMILESCCCC1CN(Cc2ccccc2)CCC1O
InChIInChI=1S/C15H23NO/c1-2-6-14-12-16(10-9-15(14)17)11-13-7-4-3-5-8-13/h3-5,7-8,14-15,17H,2,6,9-12H2,1H3
InChIKeySJGIRDXKYCMPOK-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.67
Rot. Bonds4

About 1-benzyl-3-propylpiperidin-4-ol

1-benzyl-3-propylpiperidin-4-ol (PubChem CID 23003650) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 1-benzyl-3-propylpiperidin-4-ol.

Molecular Properties

Compound Name1-benzyl-3-propylpiperidin-4-ol
PubChem CID23003650
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name1-benzyl-3-propylpiperidin-4-ol
SMILESCCCC1CN(Cc2ccccc2)CCC1O
InChIInChI=1S/C15H23NO/c1-2-6-14-12-16(10-9-15(14)17)11-13-7-4-3-5-8-13/h3-5,7-8,14-15,17H,2,6,9-12H2,1H3
InChIKeySJGIRDXKYCMPOK-UHFFFAOYSA-N
XLogP2.67
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-benzyl-3-ethylpiperidin-4-ol
CID 23003710
1-benzyl-3-(hydroxymethyl)piperidin-4-ol;methanol
CID 158581006
1-benzyl-3-[(4-ethylphenyl)methyl]piperidin-4-ol
CID 110538160
1-benzyl-3-propylpyrrolidine
CID 12648211
3-(4-anilinobutyl)-1-benzylpiperidin-4-ol
CID 91699509
1-benzyl-3-methoxypiperidin-4-ol
CID 54277205
1-benzyl-3-propan-2-ylpiperidin-4-ol
CID 23003711
[(3R,4S)-1-benzyl-4-(methylamino)piperidin-3-yl]methanol
CID 129426999
(3S,4R)-4-amino-1-benzylpiperidin-3-ol;hydrochloride
CID 67227523
(3R,4S)-1-benzyl-4-(hydroxymethyl)piperidin-3-ol
CID 15450831
(3R,4R)-4-amino-1-benzylpiperidin-3-ol;dihydrochloride
CID 163338239
(3R)-1-benzyl-3-methylpyrrolidine;propane
CID 159003320

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-3-propylpiperidin-4-ol?
The IUPAC name of 1-benzyl-3-propylpiperidin-4-ol (CID 23003650) is 1-benzyl-3-propylpiperidin-4-ol.
What is the SMILES notation for 1-benzyl-3-propylpiperidin-4-ol?
The canonical SMILES for 1-benzyl-3-propylpiperidin-4-ol is CCCC1CN(Cc2ccccc2)CCC1O.
What is the InChIKey of 1-benzyl-3-propylpiperidin-4-ol?
The InChIKey is SJGIRDXKYCMPOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-2-6-14-12-16(10-9-15(14)17)11-13-7-4-3-5-8-13/h3-5,7-8,14-15,17H,2,6,9-12H2,1H3.
What are the key properties of 1-benzyl-3-propylpiperidin-4-ol?
1-benzyl-3-propylpiperidin-4-ol has a molecular weight of 233.36 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-3-propylpiperidin-4-ol is sourced from PubChem (CID 23003650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).