1-benzyl-3-propan-2-ylpiperidin-4-ol

C15H23NO — CID 23003711

IUPAC1-benzyl-3-propan-2-ylpiperidin-4-ol
SMILESCC(C)C1CN(Cc2ccccc2)CCC1O
InChIInChI=1S/C15H23NO/c1-12(2)14-11-16(9-8-15(14)17)10-13-6-4-3-5-7-13/h3-7,12,14-15,17H,8-11H2,1-2H3
InChIKeyQHPKKOLTQRUHPB-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.53
Rot. Bonds3

About 1-benzyl-3-propan-2-ylpiperidin-4-ol

1-benzyl-3-propan-2-ylpiperidin-4-ol (PubChem CID 23003711) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 1-benzyl-3-propan-2-ylpiperidin-4-ol.

Molecular Properties

Compound Name1-benzyl-3-propan-2-ylpiperidin-4-ol
PubChem CID23003711
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name1-benzyl-3-propan-2-ylpiperidin-4-ol
SMILESCC(C)C1CN(Cc2ccccc2)CCC1O
InChIInChI=1S/C15H23NO/c1-12(2)14-11-16(9-8-15(14)17)10-13-6-4-3-5-7-13/h3-7,12,14-15,17H,8-11H2,1-2H3
InChIKeyQHPKKOLTQRUHPB-UHFFFAOYSA-N
XLogP2.53
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-benzyl-3-ethylpiperidin-4-ol
CID 23003710
(1R)-1-[(3S)-1-benzylpyrrolidin-3-yl]ethanol
CID 96766487
1-benzyl-3-(hydroxymethyl)piperidin-4-ol;methanol
CID 158581006
1-benzyl-3-methoxypiperidin-4-ol
CID 54277205
1-benzyl-3-propylpiperidin-4-ol
CID 23003650
(3R,4R)-1-benzyl-4-hydroxypiperidine-3-carboxylic acid
CID 70556270
(3S,4R)-1-benzyl-4-propan-2-ylpyrrolidine-3-carboxylic acid;hydrochloride
CID 67998457
1-[(3R)-1-benzylpyrrolidin-3-yl]-2-methylpropan-1-one
CID 59669005
(3R,4R)-1-benzyl-4-phenylpiperidin-3-ol
CID 54282589
(1S)-1-[(3S)-1-benzylpyrrolidin-3-yl]ethanamine;dihydrochloride
CID 71741811
methyl (3S,4S)-1-benzyl-4-hydroxypiperidine-3-carboxylate
CID 54043157
methyl (3R,4S)-1-benzyl-4-hydroxypiperidine-3-carboxylate
CID 86328839

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-3-propan-2-ylpiperidin-4-ol?
The IUPAC name of 1-benzyl-3-propan-2-ylpiperidin-4-ol (CID 23003711) is 1-benzyl-3-propan-2-ylpiperidin-4-ol.
What is the SMILES notation for 1-benzyl-3-propan-2-ylpiperidin-4-ol?
The canonical SMILES for 1-benzyl-3-propan-2-ylpiperidin-4-ol is CC(C)C1CN(Cc2ccccc2)CCC1O.
What is the InChIKey of 1-benzyl-3-propan-2-ylpiperidin-4-ol?
The InChIKey is QHPKKOLTQRUHPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-12(2)14-11-16(9-8-15(14)17)10-13-6-4-3-5-7-13/h3-7,12,14-15,17H,8-11H2,1-2H3.
What are the key properties of 1-benzyl-3-propan-2-ylpiperidin-4-ol?
1-benzyl-3-propan-2-ylpiperidin-4-ol has a molecular weight of 233.36 g/mol, XLogP of 2.53, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-3-propan-2-ylpiperidin-4-ol is sourced from PubChem (CID 23003711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).